HCID59635800

(S)-3-((S)-1-(4-(1-ethyl-6-oxo-1,6-dihydropyridin-3-yl)phenyl)ethyl)-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one

(6S)-3-[(1S)-1-[4-(1-ethyl-6-oxo-3-pyridinyl)phenyl]ethyl]-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one

C29H34N2O4474.6 g/mol

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IDENTITY

结构与身份

标准SMILES: CCn1cc(-c2ccc([C@H](C)N3CC[C@](CC(C)(C)O)(c4ccccc4)OC3=O)cc2)ccc1=O
InChIKey: ZABDLBFFXBIVLQ-LGGPFLRQSA-N
分子式: C29H34N2O4
平均分子量: 474.6 g/mol
单同位素质量: 474.25185757

COMPUTED

结构计算性质

已同步

XLogP: 3.8
极性表面积: 70.1 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 7
重原子: 35
形式电荷: 0
复杂度: 836

ALIASES

名称与别名

共 6 条

SCHEMBL116853CHEMBL3664660ZABDLBFFXBIVLQ-LGGPFLRQSA-NBDBM107604US8575157, 53(S)-3-((S)-1-(4-(1-ethyl-6-oxo-1,6-dihydropyridin-3-yl)phenyl)ethyl)-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one

REACTIONS