Tag: M.W:100-200

Reactions catalyzed within inorganic and organic materials and at electrochemical interfaces commonly occur at high coverage and in condensed media, causing turnover rates to depend strongly on interfacial structure and composition, 65-71-4, Name is 5-Methylpyrimidine-2,4(1H,3H)-dione, SMILES is O=C1NC(C(C)=CN1)=O, in an article , author is Algohary, Ayman M., once mentioned of 65-71-4, COA of Formula: C5H6N2O2.

Design, Synthesis And Evaluation Of New Chemosensors Containing Quinazolinones Moiety For Ions In An Aqueous Medium And Biological Samples

Quinazolinone derivatives were reported as a varied range of biological activity and played a principal part metabolism of all biological systems. The quinazolinone is an organic compound ring containing two merged aromatic rings benzene and pyrimidine. The current project deals with the design and synthesizing new Quinazolinones derivatives and evaluate them as colorimetric chemosensors to detect the cations in the aqueous medium and biological sample. The synthetic strategy depends on acylation of anthranilic acid (1) with butyroyl chloride followed by ring closure to yield benzoxazinone (2), which was reacted with various nucleophiles hydrazine hydrate, urea, thiourea, p-aminophenol, hydroxylamine, and phenyl hydrazine to give corresponding quinazolinone chemosensors 3-amino-2-propylquinazolin-4(3H)-ones (4), 6-nitro-4-oxo-2-propylquinazoline-3(4H)-carboxamide (5a), 6-nitro-4-oxo-2-propylquinazoline-3(4H)-carbothioamide (5b), 3-(2-hydroxyphenyl)-6-nitro-2-propylquinazolin-4(3H)-one (6), 3-hydroxy-2-propylquinazolin-4(3H)-ones (7) and 6-nitro-3-(phenylamino)-2-propylquinazolin-4(3H)-one (8). The importance of producing chemosensors has increased in the last decade. Therefore, here we developed and synthesized chemosensors 4 and 8 with high-selectivity and specificity to detect copper and mercury in both aqueous solutions and blood samples. Where the results showed that chemosesors 4 and 8 exhibited colormetric responses from pale yellow to green in case of Cu2+ ions and exhibited remarkable color change from pale yellow to rose by interacting with Hg2+. Chemosensors 5b and 7 show high selectivity toward cadmium ion, whereas chemosensors 5b and 7 exhibited remarkable color change from colorless to yellow when adding Cd2+. but the synthesized compounds 5a and 6 did not exhibit colorimetric response in all cation’s samples. In addition, the synthesized chemosensor was established as a strip paper to make the measurement process easy and inexpensive. All the synthesized compounds have been established by instrumental spectroscopy; 1HNMR, 13CNMR, IR, and mass spectra (ms).

But sometimes, even after several years of basic chemistry education, it is not easy to form a clear picture on how they govern reactivity! 65-71-4, you can contact me at any time and look forward to more communication. COA of Formula: C5H6N2O2.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Reference of 22536-61-4, Children learn through play, and they learn more than adults might expect. Science experiments are a great way to spark their curiosity, 22536-61-4, Name is 2-Chloro-5-methylpyrimidine, SMILES is CC1=CN=C(Cl)N=C1, belongs to pyrimidines compound. In a article, author is Litvinov, R. A., introduce new discover of the category.

Prediction of Antiglycation Activity by Calculating the Energies of Frontier Molecular Orbitals for New 4-Hydroxy-1,4-Dihydroazolo[5,1-c]-1,2,4-Triazines Used as an Example

Protein glycation and the formation of advanced glycation end products (AGEs) play an important role in the pathogenesis of diabetes mellitus (DM) complications, neurodegenerations, and age-related diseases. A model to predict antiglycation activity can reduce the costs and increase the productivity and quality of preclinical screening studies of new compounds. Azolo[5,1-c][1,2,4]triazines and azolo[1,5-a]pyrimidines are well known as biologically active compounds, which additionally have antiglycation properties. A number of 4-hydroxy-4H-azolo-1,4-dihydro[5.1-c]-1,2,4-triazines were selected for designing a prediction model. Azolotriazine derivatives were found to exert an antiglycation effect, inhibiting glycation of bovine serum albumin (BSA) with glucose and specific END fluorescence with equal or greater efficiency as compared with aminoguanidine. The activity range at 1000 mu M was estimated at 23.0-71.6% for variously substituted derivatives (30.3 +/- 1.2% for aminoguanidine). The highest activity was observed for 4-hydroxy-3-cyano-1,4-dihydro-1,2,4-triazolo[5.1-c]1,2,4-triazine. In all but one compound (aminoguanidine), antiglycation activity correlated with the energy difference increment ((HOMO – LUMO)) between the highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO); the difference was established by a PM3 semiempirical method. Artificial neural network modeling was used to develop a mathematical model that describes the dependence of antiglycation activity on the calculated energies. The E-LUMO and increment ((HOMO – LUMO)) energies were found to make the largest contribution to the activity. The model can be used to predict antiglycation activity.

Reference of 22536-61-4, Because enzymes can increase reaction rates by enormous factors and tend to be very specific, typically producing only a single product in quantitative yield, they are the focus of active research.you can also check out more blogs about 22536-61-4.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Reference of 20980-22-7, As an important bridge between the micro and macro material world, chemistry is one of the main methods and means for humans to understand and transform the material world. 20980-22-7, Name is 2-(Piperazin-1-yl)pyrimidine, SMILES is C1(N2CCNCC2)=NC=CC=N1, belongs to pyrimidines compound. In a article, author is Puttock, Emma, V, introduce new discover of the category.

Platinum(II) Complexes of Tridentate (NN- boolean AND N)-N-boolean AND -Coordinating Ligands Based on Imides, Amides, and Hydrazides: Synthesis and Luminescence Properties

Five Pt(II) complexes are described in which the metal ion is bound to anionic (NNN)-N-boolean AND-N-boolean AND-coordinating ligands. The central, deprotonated N atom is derived from an imide Ar-C(=O)-NH-C(=O)-Ar {PtL1-2Cl; Ar=pyridine or pyrimidine}, an amide py-C(=O)-NH-CH2-py {(PtLCl)-Cl-3}, or a hydrazide py-C(=O)-NH-N=CH-py {(PtLCl)-Cl-4}. The imide complexes PtL1-2Cl show no significant emission in solution but are modestly bright green/yellow phosphors in the solid state. (PtLCl)-Cl-3 is weakly phosphorescent. (PtLCl)-Cl-4 is formed as a mixture of isomers, bound through either the amido or imino nitrogen, the latter converting to the former upon absorption of light. Remarkably, the imino form displays fluorescence in solution, lambda(0,0)=535 nm, whereas the amido shows phosphorescence, lambda(0,0)=624 nm, tau=440 ns. It is highly unusual for two isomeric compounds to display emission from states of different spin multiplicity. The amido-bound (PtLCl)-Cl-4 can act as a bidentate (ON)-N-boolean AND -coordinating ligand, demonstrated by the formation of bimetallic complexes with iridium(III) or ruthenium(II).

Reference of 20980-22-7, The reactant in an enzyme-catalyzed reaction is called a substrate. Enzyme inhibitors cause a decrease in the reaction rate of an enzyme-catalyzed reaction.I hope my blog about 20980-22-7 is helpful to your research.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Let¡¯s face it, organic chemistry can seem difficult to learn, Name: 5-Methylpyrimidine-2,4(1H,3H)-dione, Especially from a beginner¡¯s point of view. Like 65-71-4, Name is 5-Methylpyrimidine-2,4(1H,3H)-dione, molecular formula is C8H7BrO, belongs to ketones-buliding-blocks compound. In a document, author is Shi, Meng, introducing its new discovery.

Alterations and Correlations in Microbial Community and Metabolome Characteristics in Generalized Aggressive Periodontitis

This study aimed to characterize the microbial community and metabolic profiles in generalized aggressive periodontitis (AgP) using 16S ribosomal RNA (rRNA) gene high-throughput sequencing and gas chromatography-mass spectrometry (GC-MS). A total of 146 subgingival plaque samples and 50 gingival crevicular fluid (GCF) samples were collected from 24 patients with AgP and 10 periodontally healthy subjects (PH). Striking differences were observed in subgingival microbiome and GCF metabolomics between patients with AgP and PH, but not between samples with different probing depths (PDs). Metabolomics analysis combined with enrichment analysis showed that periodontitis significantly altered the concentration of compounds associated with biosynthesis of amino acids (e.g., alanine, leucine, isoleucine, and valine), galactose metabolism (e.g., myo-inositol, galactose, glucose, and hexitol), and pyrimidine metabolism (e.g., uracil, uridine, beta alanine, and thymine). Correlation analysis showed that the genera with significant difference between AgP and PH were usually significantly correlated with more metabolites, such as Aggregatibacter, Rothia, Peptostreptococcaceae_[XI][G-5], and Bacteroidaceae_[G-1]. While glucose and oxoproline had the most significant correlations with microorganisms. Our results revealed distinct microbial communities and metabolic profiles between AgP and PH. The significant correlation between microbial taxa and metabolites suggested the possible mechanisms for periodontitis. Our results also provided effective approaches for detecting periodontal disease and managing periodontitis.

If you are hungry for even more, make sure to check my other article about 65-71-4, Name: 5-Methylpyrimidine-2,4(1H,3H)-dione.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Application of 671-35-2, Catalysts allow a reaction to proceed via a pathway that has a lower activation energy than the uncatalyzed reaction. 671-35-2, Name is 5-Fluoro-4-hydroxypyrimidine, SMILES is O=C1NC=NC=C1F, belongs to pyrimidines compound. In a article, author is Sivakrishna, Balija, introduce new discover of the category.

Design, synthesis and cytotoxic evaluation of truncated 3 ‘-deoxy-3 ‘, 3 ‘ difluororibofuranosyl pyrimidine nucleosides

Truncated 3′-deoxy- 3′, 3′ difluororibofuranosyl pyrimidine nucleoside derivatives were synthesized from D-ribose via beta-apioribo pyrimidine nucleoside intermediates 11a-c. The synthetic approach signifies that truncation at C3’ position of apioribose ring of 13a-c by oxidative cleavage of diols with Pb(OAc)(4) and followed by fluorination with DAST as key steps. Cytotoxic evaluation of synthesized truncated nucleoside derivatives 16a-c and 19a-c were tested against MCF7 and MDA-MB-231 breast cancer cell lines. However, only 19a was shown minimal growth suppression activity on MDA-MB-231 cancer cell lines.

Application of 671-35-2, One of the oldest and most widely used commercial enzyme inhibitors is aspirin, which selectively inhibits one of the enzymes involved in the synthesis of molecules that trigger inflammation. you can also check out more blogs about 671-35-2.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

In an article, author is Luo, Guolin, once mentioned the application of 22536-61-4, Recommanded Product: 2-Chloro-5-methylpyrimidine, Name is 2-Chloro-5-methylpyrimidine, molecular formula is C5H5ClN2, molecular weight is 128.56, MDL number is MFCD09260903, category is pyrimidines. Now introduce a scientific discovery about this category.

Design, synthesis and antitumor evaluation of novel 5-methylpyrazolo [1,5-a] pyrimidine derivatives as potential c-Met inhibitors

A series of novel 5-methylpyrazolo[1,5-a]pyrimidine derivatives (10a-10x) were designed, synthesized, and evaluated for their in vitro inhibitory activities against c-Met kinase and antiproliferative activities against the SH-SY5Y, MDA-MB-231, A549, and HepG2 cell lines. Most of the compounds remarkably inhibited c-Met kinase and showed moderate to good cytotoxicity and selectivity toward the four cancer cell lines. Among them, compounds 10b and 10f were the two most potent selective c-Met inhibitors with half-maximal inhibitory concentration (IC50) values of 5.17 +/- 0.48 nM and 5.62 +/- 0.78 nM, respectively, and suppression abilities comparable with the positive control cabozantinib. Cell proliferation assay further demonstrated that the two most promising compounds 10a and 10b also showed good cytotoxicity and selectivity toward MDA-MB-231 cells, with IC50 values of 26.67 +/- 2.56 mu M and 26.83 +/- 2.41 mu M, respectively. Compounds 10f and 10g showed cytotoxicity and selectivity toward A549 cells, with IC50 values of 20.20 +/- 2.04 mu M and 21.65 +/- 1.58 mu M, respectively. All antiproliferative activities were within the range of those of cabozantinib. Notably, these compounds presented relatively low hepatotoxicity compared with reference drugs. Moreover, the preliminary structure-activity relationship and docking studies revealed that replacement of a nitrogen-containing heterocycle on the R-2 (block A) group might improve the c-Met kinase inhibitory and antiproliferative effects in MDAMB-231 cells, whereas displacement by a substituted benzene ring, especially for the p-fluorophenyl or 4-fluoro3-methoxyphenyl moiety, on the R-2 group enhanced cytotoxicity toward A549 cells. Together, these results suggest that 10b and 10f are promising compounds and provide a basis for their development as new antitumor agents.

If you are interested in 22536-61-4, you can contact me at any time and look forward to more communication. Recommanded Product: 2-Chloro-5-methylpyrimidine.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Related Products of 4318-56-3, As an important bridge between the micro and macro material world, chemistry is one of the main methods and means for humans to understand and transform the material world. 4318-56-3, Name is 6-Chloro-3-methylpyrimidine-2,4(1H,3H)-dione, SMILES is O=C1N(C)C(C=C(Cl)N1)=O, belongs to pyrimidines compound. In a article, author is Yang, Xuerui, introduce new discover of the category.

Direct oxidation of antibiotic trimethoprim by unactivated peroxymonosulfate via a nonradical transformation mechanism

Application of activated peroxymonosulfate (PMS) to generate sulfate radical or hydroxyl radical is a promising strategy for wastewater treatment, while our knowledge on the background reaction, namely, the direct interaction between PMS and target contaminants is quite limited. In this contribution, the degradation kinetics, stoichiometry, products and mechanism of the reaction between unactivated PMS and trimethoprim (TMP), one of the most commonly detected micro-pollutants in the aquatic system were investigated systematically. The results indicated that TMP was susceptible to degradation by direct PMS oxidation via a non-radical process. By recording the decay of two reactants simultaneously, the stoichiometric ratio between PMS and TMP was estimated to be approximately 1. Higher PMS levels exhibited a promotion effect on PMS decay. And the degradation was pH-dependent, basic conditions were favorable for TMP degradation, which could be well modeled based on the species-specific reactions. The two amine groups on the pyrimidine ring were identified as the reactive sites. After direct attacks by PMS, they would be oxidized to form hydroxylamine-products, namely, N-8-OH-TMP and N-9-OH-TMP. These two hydroxylamine-products were quite stable and resistant to further oxidation by PMS, preventing the formation of more toxic nitroso- and nitro-products. The new findings in the present work would provide beneficial information on the strategy choice for the elimination of specific pollutants, like TMP, as PMS also exhibits relatively high reactivity towards them. (C) 2020 Elsevier Ltd. All rights reserved.

Related Products of 4318-56-3, Enzymes are biological catalysts that produce large increases in reaction rates and tend to be specific for certain reactants and products. I hope my blog about 4318-56-3 is helpful to your research.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Related Products of 671-35-2, The transformation of simple hydrocarbons into more complex and valuable products via catalytic C¨CH bond functionalisation has revolutionised modern synthetic chemistry. 671-35-2, Name is 5-Fluoro-4-hydroxypyrimidine, SMILES is O=C1NC=NC=C1F, belongs to pyrimidines compound. In a article, author is Sauter, Eric, introduce new discover of the category.

Pronounced Solvent Effect on the Composition of Binary Self-Assembled Monolayers with Embedded Dipole Moments

The formation and properties of binary thiolate self-assembled monolayers (SAMs), comprised of precursors featuring a short heteroaromatic backbone, consisting of a nonpolar phenyl ring and a polar pyrimidine group, embedded in two opposite orientations, were investigated in the context of work function engineering. The SAMs were prepared by coadsorption of both constituents dissolved in either tetrahydrofuran (THF) or ethanol, exhibiting a strong solvent effect. In the case of THF, the SAM composition nearly mimicked that of the primary solutions, with a slight preference of the 50%-50% relation, which was accompanied by the respective gradual variation of the work function, allowing its fine-tuning within the 4.0-4.9 eV range for Au(111). In the case of ethanol, a strongly preferential adsorption of one of the components was observed, limiting significantly the range of the work function variation. The effect of the solvent was tentatively explained by the different abilities of THF and ethanol to build hydrogen bonds to the SAM precursors, affecting their adsorption and self-assembly behavior. The composition and morphology of the binary SAMs were monitored by the electrostatic effects in photoemission, manifesting these effects as a useful experimental tool and a fingerprint parameter for the work function estimation.

Related Products of 671-35-2, Each elementary reaction can be described in terms of its molecularity, the number of molecules that collide in that step. The slowest step in a reaction mechanism is the rate-determining step.you can also check out more blogs about 671-35-2.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Reference of 65-71-4, Children learn through play, and they learn more than adults might expect. Science experiments are a great way to spark their curiosity, 65-71-4, Name is 5-Methylpyrimidine-2,4(1H,3H)-dione, SMILES is O=C1NC(C(C)=CN1)=O, belongs to pyrimidines compound. In a article, author is Wang, Shuai, introduce new discover of the category.

Structure-Based Design, Synthesis, and Biological Evaluation of New Triazolo[1,5-a]Pyrimidine Derivatives as Highly Potent and Orally Active ABCB1 Modulators

ABCB1 is a promising therapeutic target for overcoming multidrug resistance (MDR). In this work, we reported the structure-based design of triazolo[1,5-a]pyrimidines as new ABCB1 modulators, of which WS-691 significantly increased sensitization of ABCB1-overexpressed SW620/Ad300 cells to paclitaxel (PTX) (IC50 = 22.02 nM). Mechanistic studies indicated that WS-691 significantly increased the intracellular concentration of PTX and [H-3]-PTX while decreasing the efflux of [H-3]-PTX in SW620/Ad300 cells by inhibiting the efflux function of ABCB1. The cellular thermal shift assay suggested that WS-691 could stabilize ABCB1 by directly binding to ABCB1. WS-691 could stimulate the activity of ABCB1 ATPase but had almost no inhibitory activity against CYP3A4. Importantly, WS-691 increased the sensitivity of SW620/Ad300 cells to PTX in vivo without observed toxicity. Collectively, WS-691 is a highly potent and orally active ABCB1 modulator capable of overcoming MDR. The triazolo[1,5-a]dpyrimidine may be a promising scaffold for developing more potent ABCB1 modulators.

Reference of 65-71-4, The reactant in an enzyme-catalyzed reaction is called a substrate. Enzyme inhibitors cause a decrease in the reaction rate of an enzyme-catalyzed reaction.I hope my blog about 65-71-4 is helpful to your research.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia

Electric Literature of 5399-92-8, Enzymes are biological catalysts that produce large increases in reaction rates and tend to be specific for certain reactants and products. 5399-92-8, Name is 4-Chloro-1H-pyrazolo[3,4-d]pyrimidine, SMILES is ClC1=C2C(NN=C2)=NC=N1, belongs to pyrimidines compound. In a article, author is Irfan, Ahmad, introduce new discover of the category.

Push-pull effect on the charge transport characteristics in V-shaped organic semiconductor materials

With the goal to tune charge transport and electronic properties of 4,6-di(thiophen-2-yl)pyrimidine (DTP) structure, seven novel V-shaped organic semiconductor compounds were designed by nitrogen doping, oligocenes pi -bridge incorporations and push-pull strategy. Primarily, 4,6-bis-thiazol-2-yl-pyrimidine (1) was designed by nitrogen atoms doping in DTP. Then push-pull system named 1DA was designed by substituting -N(CH3)(2) at R-1 and R-2, while -CF3 at R-3 and R-4 positions of 1. Moreover, various semiconducting materials (2DA-6DA) with tuned properties were designed from 1DA by fusing benzene, naphthalene, anthracene, tetracene and pentacene at both ends. The density functional theory (DFT) and time-dependent DFT were adopted for optimizing the ground and excited state structures, correspondingly. We investigated frontier molecular orbitals, photo-stability, electron injection, electron affinity (EA), ionization energies (IE) and reorganization energies. The push-pull and pi -bridge elongation strategies ominously raise EA while diminish IE values, which may lead to decrease the electron and hole injection obstruction. Besides, donors-acceptors and oligocenes at both ends meaningfully drop the electron reorganization energy values as compared to normally used n-type material, i.e., tris(8-hydroxyquinolinato)aluminium (mer-Alq3). These results revealed that newly designed materials 4DA-6DA would be proficient to be used in n-type semiconductor devices.

Electric Literature of 5399-92-8, Because enzymes can increase reaction rates by enormous factors and tend to be very specific, typically producing only a single product in quantitative yield, they are the focus of active research.you can also check out more blogs about 5399-92-8.

Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia