HIT ID: HIT212671220
Cas No:
分子式: C21H24ClN5O3S
分子量: 461.97
常用名: CCR1 antagonist 7
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 3.251618
IUPAC: 1-(4-chlorophenyl)-5-methyl-N-[(1S)-1-[2-(methylsulfamoyl)pyridin-4-yl]butyl]-1H-pyrazole-4-carboxamide
IUPAC: 1-(4-chlorophenyl)-5-methyl-N-[(1S)-1-[2-(methylsulfamoyl)pyridin-4-yl]butyl]-1H-pyrazole-4-carboxamide
SMILES: CCC[C@H](NC(=O)c1cnn(c1C)-c1ccc(Cl)cc1)c1ccnc(c1)S(=O)(=O)NC
SMILES: CCC[C@H](NC(=O)c1cnn(c1C)-c1ccc(Cl)cc1)c1ccnc(c1)S(=O)(=O)NC
InChI key: KMKFKHSVNQHEJL-IBGZPJMESA-N