HCID11330705

7-[2-(4-Fluorophenyl)-5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-3,5-dioxo-heptanoic acid, ethyl ester

ethyl 7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dioxoheptanoate

C35H35FN2O5582.7 g/mol

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)CC(=O)CC(=O)CCn1c(-c2ccc(F)cc2)c(-c2ccccc2)c(C(=O)Nc2ccccc2)c1C(C)C
InChIKey: DUSGPCRKWKRZMY-UHFFFAOYSA-N
分子式: C35H35FN2O5
平均分子量: 582.7 g/mol
单同位素质量: 582.25300038

COMPUTED

结构计算性质

等待补全

XLogP: 5.9
极性表面积: 94.5 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 14
重原子: 43
形式电荷: 0
复杂度: 937

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 4 条

SCHEMBL6318546DUSGPCRKWKRZMY-UHFFFAOYSA-N7-[2-(4-fluorophenyl) -5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-3,5-dioxo-heptanoic acid, ethyl ester7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-phenylcarbamoyl-pyrrol-1-yl]-3,5-dioxo-heptanoic acid, ethyl ester

REACTIONS