Catalysts are substances that increase the reaction rate of a chemical reaction without being consumed in the process. 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 document, author is Gong, Yi-Lin, introduce the new discover, Computed Properties of C5H6N2O2.
Synthesis, Crystal Structure and Biological Activity of 7-(4-Methylpiperazin-1-Yl)-5-[4-(Trifluoromethyl)Phenyl]pyrazolo[1,5-a]Pyrimidine-3-Carbonitrile
The title compound C19H17F3N6 was synthesized and structurally characterized by infrared and mass spectroscopy, H-1 NMR, elemental analyses and single crystal X-ray diffraction. The compound crystallizes in monoclinic system, space group P2(1)/c with a = 17.097(4) angstrom, b = 7.1668(16) angstrom, c = 18.389(3) angstrom, beta = 118.251(15)degrees, V = 1984.8(8) angstrom(3), Z = 4, D-c = 1.293 g cm(-3), F(000) = 800, mu(MoK alpha) = 0.10 mm(-1), R-1 = 0.0667, and wR(2) = 0.2084 for reflections with I > 2 sigma(I). Pyrazolo[1,5-a]pyrimidine and phenyl ring are almost coplanar, and the piperazine ring is in a chair conformation. The crystal structure is stabilized by C-H…N hydrogen interactions and a number of weak pi…pi interactions. In addition, the results of the determination of biological activity showed that the compound exhibited significant inhibitory activity against K562 and MKN45 cancer cell lines.
The proportionality constant is the rate constant for the particular unimolecular reaction. the reaction rate is directly proportional to the concentration of the reactant. I hope my blog about 65-71-4 is helpful to your research. Computed Properties of C5H6N2O2.
Reference:
Pyrimidine | C4H4N2 – PubChem,
,Pyrimidine – Wikipedia