HCID86643185

ethyl (2E)-3-(1-(2-(4-((2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino)piperidin-1-yl)ethyl)-7-methoxy-2-oxo-1,2-dihydroquinolin-5-yl)acrylate

ethyl (E)-3-[1-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidin-1-yl]ethyl]-7-methoxy-2-oxoquinolin-5-yl]prop-2-enoate

C31H37N3O6547.6 g/mol

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)/C=C/c1cc(OC)cc2c1ccc(=O)n2CCN1CCC(NCc2ccc3c(c2)OCCO3)CC1
InChIKey: LOYOYSQCGNDDLE-WEVVVXLNSA-N
分子式: C31H37N3O6
平均分子量: 547.6 g/mol
单同位素质量: 547.26823591

COMPUTED

结构计算性质

已同步

XLogP: 3.5
极性表面积: 89.6 Å²
氢键供体: 1
氢键受体: 8
可旋转键: 11
重原子: 40
形式电荷: 0
复杂度: 904

ALIASES

名称与别名

共 4 条

SCHEMBL13264351LOYOYSQCGNDDLE-WEVVVXLNSA-Nethyl (2E)-3-(1-(2-(4-((2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino)piperidin-1-yl)ethyl)-7-methoxy-2-oxo-1,2-dihydroquinolin-5-yl)acrylateethyl (2E)-3-(l-(2-(4-((2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino)piperidin-1-yl)ethyl)-7-methoxy-2-oxo-1,2-dihydroquinolin-5-yl)acrylate

REACTIONS

参与反应

4 条

uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08524738B2

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uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08524738B2

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uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08329694B2

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uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08329694B2

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