HIT ID: HIT212709820
Cas No: 1177798-88-7
分子式: C35H46Cl3N7O2
分子量: 703.15
常用名: Braco-19 trihydrochloride
氢键受体数 (HBA): 7
氢键供体数 (HBD): 3
LogP: 4.598235
IUPAC: N-(9-{[4-(dimethylamino)phenyl]amino}-6-[3-(pyrrolidin-1-yl)propanamido]acridin-3-yl)-3-(pyrrolidin-1-yl)propanamide trihydrochloride
IUPAC: N-(9-{[4-(dimethylamino)phenyl]amino}-6-[3-(pyrrolidin-1-yl)propanamido]acridin-3-yl)-3-(pyrrolidin-1-yl)propanamide trihydrochloride
SMILES: Cl.Cl.Cl.CN(C)c1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)cc1
SMILES: Cl.Cl.Cl.CN(C)c1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)cc1
InChI key: MJAPNWJRLLDPAB-UHFFFAOYSA-N
