HIT ID: HIT212036110
Cas No: 1235560-28-7
分子式: C20H20ClF2N3O3S
分子量: 455.9
常用名: ABT-639
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 2.0746386
IUPAC: 5-[(8aR)-octahydropyrrolo[1,2-a]pyrazine-2-carbonyl]-4-chloro-2-fluoro-N-(2-fluorophenyl)benzene-1-sulfonamide
IUPAC: 5-[(8aR)-octahydropyrrolo[1,2-a]pyrazine-2-carbonyl]-4-chloro-2-fluoro-N-(2-fluorophenyl)benzene-1-sulfonamide
SMILES: [H][C@]12CCCN1CCN(C2)C(=O)c1cc(c(F)cc1Cl)S(=O)(=O)Nc1ccccc1F
SMILES: [H][C@]12CCCN1CCN(C2)C(=O)c1cc(c(F)cc1Cl)S(=O)(=O)Nc1ccccc1F
InChI key: AGPIHNZOZNKRGT-CYBMUJFWSA-N
