HCID86698845

4,6-difluoro-5-(4-(1-(hydroxymethyl)cyclobutyl)phenyl)-1H-indole-3-carbaldehyde

4,6-difluoro-5-[4-[1-(hydroxymethyl)cyclobutyl]phenyl]-1H-indole-3-carbaldehyde

C20H17F2NO2341.4 g/mol

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IDENTITY

结构与身份

标准SMILES: O=Cc1c[nH]c2cc(F)c(-c3ccc(C4(CO)CCC4)cc3)c(F)c12
InChIKey: VCAHICAEBQNYMK-UHFFFAOYSA-N
分子式: C20H17F2NO2
平均分子量: 341.4 g/mol
单同位素质量: 341.12273511

COMPUTED

结构计算性质

已同步

XLogP: 3.7
极性表面积: 53.1 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 4
重原子: 25
形式电荷: 0
复杂度: 490

ALIASES

名称与别名

共 4 条

4,6-difluoro-5-(4-(1-(hydroxymethyl)cyclobutyl)phenyl)-1H-indole-3-carbaldehyde4,6-difluoro-5-{4-[1-(hydroxymethyl)cyclobutyl]phenyl}-1H-indole-3-carbaldehydeSCHEMBL15300662VCAHICAEBQNYMK-UHFFFAOYSA-N

REACTIONS

参与反应

4 条

uspto-grants-2014_11 · 10.6084/m9.figshare.5104873.v1 · US08889730B2

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uspto-grants-2014_11 · 10.6084/m9.figshare.5104873.v1 · US08889730B2

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uspto-grants-2016_07 · 10.6084/m9.figshare.5104873.v1 · US09394285B2

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uspto-grants-2016_07 · 10.6084/m9.figshare.5104873.v1 · US09394285B2

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