HCID136146945

3-[4-(cyclopropylmethoxy)-3-fluorophenyl]-2-methyl-5-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-6-propylpyrimidin-4(3H)-one

3-[2-[4-[[1-[4-(cyclopropylmethoxy)-3-fluorophenyl]-2-methyl-6-oxo-4-propylpyrimidin-5-yl]methyl]phenyl]phenyl]-4H-1,2,4-oxadiazol-5-one

C33H31FN4O4566.6 g/mol

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IDENTITY

结构与身份

标准SMILES: CCCc1nc(C)n(-c2ccc(OCC3CC3)c(F)c2)c(=O)c1Cc1ccc(-c2ccccc2-c2noc(=O)[nH]2)cc1
InChIKey: OBLVEBDSGJSWIJ-UHFFFAOYSA-N
分子式: C33H31FN4O4
平均分子量: 566.6 g/mol
单同位素质量: 566.23293364

COMPUTED

结构计算性质

已同步

XLogP: 6.1
极性表面积: 92.6 Å²
氢键供体: 1
氢键受体: 7
可旋转键: 10
重原子: 42
形式电荷: 0
复杂度: 1,110

ALIASES

名称与别名

共 3 条

SCHEMBL1890391OBLVEBDSGJSWIJ-UHFFFAOYSA-N3-[4-(cyclopropylmethoxy)-3-fluorophenyl]-2-methyl-5-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-6-propylpyrimidin-4(3H)-one

REACTIONS

参与反应

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