HIT ID: HIT218801731

Cas No: 2383086-06-2

分子式: C49H59N7O7S

分子量: 890.11

常用名: 4-{2-[(2S)-2-(2-isopropylphenyl)pyrrolidin-1-yl]-7-azaspiro[3.5]nonan-7-yl}-N-[3-nitro-4-({[(1r,4r)-4-hydroxy-4-methylcyclohexyl]methyl}amino)benzenesulfonyl]-2-{1H-pyrrolo[2,3-b]pyridin-5-yloxy}benzamide, Sonrotoclax

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: N-[3-nitro-4-({[(1r,4r)-4-hydroxy-4-methylcyclohexyl]methyl}amino)benzenesulfonyl]-4-{2-[(2S)-2-[2-(propan-2-yl)phenyl]pyrrolidin-1-yl]-7-azaspiro[3.5]nonan-7-yl}-2-{1H-pyrrolo[2,3-b]pyridin-5-yloxy}benzamide

SMILES: CC(C)c1ccccc1[C@@H]1CCCN1C1CC2(C1)CCN(CC2)c1ccc(C(=O)NS(=O)(=O)c2ccc(NC[C@H]3CC[C@](C)(O)CC3)c(c2)[N+]([O-])=O)c(Oc2cnc3[nH]ccc3c2)c1

InChI key: ZQTKOYMWCCSKON-XKXNWSITSA-N