HIT ID: HIT212673204
Cas No: 1791396-46-7
分子式: C23H32BrN3O9S3
分子量: 670.61
常用名: Masupirdine mesylate
氢键受体数 (HBA): 5
氢键供体数 (HBD): 0
LogP: 3.4009795
IUPAC: 1-(2-bromobenzenesulfonyl)-5-methoxy-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole; bis(methanesulfonic acid)
IUPAC: 1-(2-bromobenzenesulfonyl)-5-methoxy-3-[(4-methylpiperazin-1-yl)methyl]-1H-indole; bis(methanesulfonic acid)
SMILES: CS(O)(=O)=O.CS(O)(=O)=O.COc1ccc2n(cc(CN3CCN(C)CC3)c2c1)S(=O)(=O)c1ccccc1Br
SMILES: CS(O)(=O)=O.CS(O)(=O)=O.COc1ccc2n(cc(CN3CCN(C)CC3)c2c1)S(=O)(=O)c1ccccc1Br
InChI key: LOZVXBFXRPRECW-UHFFFAOYSA-N
