Solifenacin D5 hydrochloride
HIT212670470
sdf文件结构编辑类似物检索
HIT ID: HIT212670470
Cas No: 1426174-05-1
分子式: C23H27ClN2O2
分子量: 403.96
常用名: Solifenacin D5 hydrochloride
氢键受体数 (HBA): 2
氢键供体数 (HBD): 0
LogP: 3.9606059
IUPAC: (3R)-1-azabicyclo[2.2.2]octan-3-yl (1S)-1-[(2,3,4,5,6-2H5)phenyl]-1,2,3,4-tetrahydroisoquinoline-2-carboxylate hydrochloride
IUPAC: (3R)-1-azabicyclo[2.2.2]octan-3-yl (1S)-1-[(2,3,4,5,6-2H5)phenyl]-1,2,3,4-tetrahydroisoquinoline-2-carboxylate hydrochloride
SMILES: Cl.[2H]c1c([2H])c([2H])c([C@@H]2N(CCc3ccccc23)C(=O)O[C@H]2CN3CCC2CC3)c([2H])c1[2H]
SMILES: Cl.[2H]c1c([2H])c([2H])c([C@@H]2N(CCc3ccccc23)C(=O)O[C@H]2CN3CCC2CC3)c([2H])c1[2H]
InChI key: YAUBKMSXTZQZEB-BCZWPACGSA-N
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