Name: Nifeviroc
Rating: 5 (10 reviews)

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HIT ID:HIT212693194
Cas No:934740-33-7
常用名:Nifeviroc
别名:尼非韦罗, TD-0232, TD0232
IUPAC:(4-nitrophenyl)methyl N-(1-{[(3S,4R)-1-cyclopentanecarbonyl-4-hydroxy-4-phenylpyrrolidin-3-yl]methyl}piperidin-4-yl)-N-(prop-2-en-1-yl)carbamate
IUPAC:(4-nitrophenyl)methyl N-(1-{[(3S,4R)-1-cyclopentanecarbonyl-4-hydroxy-4-phenylpyrrolidin-3-yl]methyl}piperidin-4-yl)-N-(prop-2-en-1-yl)carbamate
InChI key:JNSKQYZFEVKYDB-UVMMSNCQSA-N

分子式:C33H42N4O6
分子量:590.721
氢键供体数 (HBD):1
氢键受体数 (HBA):6
LogP:4.2735085
SMILES:O[C@@]1(CN(C[C@@H]1CN1CCC(CC1)N(CC=C)C(=O)OCc1ccc(cc1)[N+]([O-])=O)C(=O)C1CCCC1)c1ccccc1
SMILES:O[C@@]1(CN(C[C@@H]1CN1CCC(CC1)N(CC=C)C(=O)OCc1ccc(cc1)[N+]([O-])=O)C(=O)C1CCCC1)c1ccccc1

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