HIT ID: HIT100034665

Cas No: -

分子式: C27H36N2O5

分子量: 468.594

常用名: Ivabradine

氢键受体数 (HBA): 3

氢键供体数 (HBD): 0

LogP: 3.7

IUPAC: 3-[3-({[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl}(methyl)amino)propyl]-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-3-benzazepin-2-one

SMILES: COc1cc2C[C@H](CN(C)CCCN3CCc4cc(OC)c(OC)cc4CC3=O)c2cc1OC

InChI key: ACRHBAYQBXXRTO-OAQYLSRUSA-N