5-Thiazolecarboxamide,N-(2-chloro-6-methylphenyl)-2-[(6-chloro-2-methyl-4-pyrimidinyl)amino]-

The N-(2-Chloro-6-methylphenyl)-2-[(6-chloro-2-methyl-4-pyrimidinyl)amino]-5-thiazolecarboxamide, with the CAS registry number 302964-08-5, is also known as 5-Thiazolecarboxamide, N-(2-chloro-6-methylphenyl)-2-[(6-chloro-2-methyl-4-pyrimidinyl)amino]-. It belongs to the product categories of Dasatinib; Heterocycles; Intermediates & Fine Chemicals; Pharmaceuticals; Sulfur & Selenium Compounds. This chemical's molecular formula is C₁₆H₁₃Cl₂N₅OS and molecular weight is 394.28. Its systematic name is called N-(2-chloro-6-methylphenyl)-2-[(6-chloro-2-methylpyrimidin-4-yl)amino]-1,3-thiazole-5-carboxamide. This chemical can be used as dasatinib intermediate and protein tyrosine kinase inhibitor.

Physical properties of N-(2-Chloro-6-methylphenyl)-2-[(6-chloro-2-methyl-4-pyrimidinyl)amino]-5-thiazolecarboxamide: (1)ACD/LogP: 2.46; (2)ACD/LogD (pH 5.5): 2.46; (3)ACD/LogD (pH 7.4): 2.46; (4)ACD/BCF (pH 5.5): 43.58; (5)ACD/BCF (pH 7.4): 43.57; (6)ACD/KOC (pH 5.5): 518.8; (7)ACD/KOC (pH 7.4): 518.65; (8)#H bond acceptors: 6; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.716; (12)Molar Refractivity: 102.3 cm³; (13)Molar Volume: 259.9 cm³; (14)Surface Tension: 70.3 dyne/cm; (15)Density: 1.516 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cccc(c1NC(=O)c2sc(nc2)Nc3nc(nc(Cl)c3)C)C
(2)InChI: InChI=1/C16H13Cl2N5OS/c1-8-4-3-5-10(17)14(8)23-15(24)11-7-19-16(25-11)22-13-6-12(18)20-9(2)21-13/h3-7H,1-2H3,(H,23,24)(H,19,20,21,22)
(3)InChIKey: LMXUWARKUIELGT-UHFFFAOYAU