HIT ID: HIT218851297
Cas No: 2894104-50-6
分子式: C34H31N5O2
分子量: 541.655
常用名: CDD-1845
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-(isoquinolin-4-yl)-1-[3-(methylcarbamoyl)propyl]-N-[(1S)-1-(naphthalen-2-yl)ethyl]-1H-1,3-benzodiazole-7-carboxamide
IUPAC: 2-(isoquinolin-4-yl)-1-[3-(methylcarbamoyl)propyl]-N-[(1S)-1-(naphthalen-2-yl)ethyl]-1H-1,3-benzodiazole-7-carboxamide
SMILES: CNC(=O)CCCn1c(nc2cccc(C(=O)N[C@@H](C)c3ccc4ccccc4c3)c12)-c1cncc2ccccc12
SMILES: CNC(=O)CCCn1c(nc2cccc(C(=O)N[C@@H](C)c3ccc4ccccc4c3)c12)-c1cncc2ccccc12
InChI key: CTPLSMAVLSTZPJ-QFIPXVFZSA-N