HIT ID: HIT212661135
Cas No: 2421117-98-6
分子式: C28H26N4O4S2
分子量: 546.66
常用名: BC-DXI-843
氢键受体数 (HBA): 5
氢键供体数 (HBD): 3
LogP: 5.770959
IUPAC: (2S)-3-(1H-indol-3-yl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(4-methylbenzenesulfonamido)propanamide
IUPAC: (2S)-3-(1H-indol-3-yl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(4-methylbenzenesulfonamido)propanamide
SMILES: COc1ccc(cc1)-c1csc(NC(=O)[C@H](Cc2c[nH]c3ccccc23)NS(=O)(=O)c2ccc(C)cc2)n1
SMILES: COc1ccc(cc1)-c1csc(NC(=O)[C@H](Cc2c[nH]c3ccccc23)NS(=O)(=O)c2ccc(C)cc2)n1
InChI key: VLPGAOXBMXGNGM-VWLOTQADSA-N
