HCID59635635

(R)-6-(4-fluorophenyl)-6-(3-hydroxypropyl)-3-((S)-1-(4-(6-oxo-1,6-dihydropyridin-3-yl)phenyl)ethyl)-1,3-oxazinan-2-one

(6R)-6-(4-fluorophenyl)-6-(3-hydroxypropyl)-3-[(1S)-1-[4-(6-oxo-1H-pyridin-3-yl)phenyl]ethyl]-1,3-oxazinan-2-one

C26H27FN2O4450.5 g/mol

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IDENTITY

结构与身份

标准SMILES: C[C@@H](c1ccc(-c2ccc(=O)[nH]c2)cc1)N1CC[C@](CCCO)(c2ccc(F)cc2)OC1=O
InChIKey: VPZOFKJQKKKCRL-HFJWLAOPSA-N
分子式: C26H27FN2O4
平均分子量: 450.5 g/mol
单同位素质量: 450.19548551

COMPUTED

结构计算性质

已同步

XLogP: 3.1
极性表面积: 78.9 Å²
氢键供体: 2
氢键受体: 5
可旋转键: 7
重原子: 33
形式电荷: 0
复杂度: 768

ALIASES

名称与别名

共 3 条

SCHEMBL116834VPZOFKJQKKKCRL-HFJWLAOPSA-N(R)-6-(4-fluorophenyl)-6-(3-hydroxypropyl)-3-((S)-1-(4-(6-oxo-1,6-dihydropyridin-3-yl)phenyl)ethyl)-1,3-oxazinan-2-one

REACTIONS