HIT ID: HIT212761988
Cas No: 1384974-37-1
分子式: C31H33ClN2O3RuS
分子量: 650.2
常用名: N-[(1S,2S)-1,2-Diphenyl-2-(2-(4-methylbenzyloxy)ethylamino)-ethyl]-4-methylbenzene sulfonamide(chloro)ruthenium(II)
常用名: N-[(1S,2S)-1,2-Diphenyl-2-(2-(4-methylbenzyloxy)ethylamino)-ethyl]-4-methylbenzene sulfonamide(chloro)ruthenium(II)
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 6.576223
IUPAC: lambda2-ruthenium(2+) (4-methylbenzenesulfonyl)[2-({2-[(4-methylphenyl)methoxy]ethyl}amino)-1,2-diphenylethyl]azanide chloride
IUPAC: lambda2-ruthenium(2+) (4-methylbenzenesulfonyl)[2-({2-[(4-methylphenyl)methoxy]ethyl}amino)-1,2-diphenylethyl]azanide chloride
SMILES: [Cl-].[Ru++].Cc1ccc(COCCNC(C([N-]S(=O)(=O)c2ccc(C)cc2)c2ccccc2)c2ccccc2)cc1
SMILES: [Cl-].[Ru++].Cc1ccc(COCCNC(C([N-]S(=O)(=O)c2ccc(C)cc2)c2ccccc2)c2ccccc2)cc1
InChI key: INKUCOHLIHBSDN-UHFFFAOYSA-M
