HIT ID: HIT212689246
Cas No: 96590-75-9
分子式: C31H30N2O4S
分子量: 526.65
常用名: Promethazine hibenzate
氢键受体数 (HBA): 2
氢键供体数 (HBD): 0
LogP: 4.287571
IUPAC: 2-(4-hydroxybenzoyl)benzoic acid; dimethyl[1-(10H-phenothiazin-10-yl)propan-2-yl]amine
IUPAC: 2-(4-hydroxybenzoyl)benzoic acid; dimethyl[1-(10H-phenothiazin-10-yl)propan-2-yl]amine
SMILES: OC(=O)c1ccccc1C(=O)c1ccc(O)cc1.CC(CN1c2ccccc2Sc2ccccc12)N(C)C
SMILES: OC(=O)c1ccccc1C(=O)c1ccc(O)cc1.CC(CN1c2ccccc2Sc2ccccc12)N(C)C
InChI key: WCYMACWVZQIWLM-UHFFFAOYSA-N