HIT ID: HIT212680594
Cas No: 916075-84-8
分子式: C25H37N5O3
分子量: 455.603
常用名: Felcisetrag
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: 2.135883
IUPAC: methyl 4-{[4-({[2-(propan-2-yl)-1H-1,3-benzodiazol-7-yl]formamido}methyl)piperidin-1-yl]methyl}piperidine-1-carboxylate
IUPAC: methyl 4-{[4-({[2-(propan-2-yl)-1H-1,3-benzodiazol-7-yl]formamido}methyl)piperidin-1-yl]methyl}piperidine-1-carboxylate
SMILES: COC(=O)N1CCC(CN2CCC(CNC(=O)c3cccc4nc([nH]c34)C(C)C)CC2)CC1
SMILES: COC(=O)N1CCC(CN2CCC(CNC(=O)c3cccc4nc([nH]c34)C(C)C)CC2)CC1
InChI key: MZOITCJKGUIQEI-UHFFFAOYSA-N
