HCID46197902

3-{2-[2-(4-bromophenyl)pyrrolidin-1-yl]ethyl}-2-methyl-1H-indole

3-[2-[2-(4-bromophenyl)pyrrolidin-1-yl]ethyl]-2-methyl-1H-indole

C21H23BrN2383.3 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1[nH]c2ccccc2c1CCN1CCCC1c1ccc(Br)cc1
InChIKey: LOYIGZPFCASQIU-UHFFFAOYSA-N
分子式: C21H23BrN2
平均分子量: 383.3 g/mol
单同位素质量: 382.10446

COMPUTED

结构计算性质

已同步

XLogP: 5.5
极性表面积: 19 Å²
氢键供体: 1
氢键受体: 1
可旋转键: 4
重原子: 24
形式电荷: 0
复杂度: 407

ALIASES

名称与别名

共 6 条

SCHEMBL1779373LOYIGZPFCASQIU-UHFFFAOYSA-N3-{2-[2-(4-bromophenyl)pyrrolidin-1-yl]ethyl}-2-methyl-1H-indole1189153-00-1DB-3391003-{2-[2-(4-bromo-phenyl)-pyrrolidin-1-yl]-ethyl}-2-methyl-1H-indole

REACTIONS

参与反应

6 条

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07943652B2

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uspto-grants-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07943652B2

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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uspto-grants-2013_01 · 10.6084/m9.figshare.5104873.v1 · US08349883B2

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uspto-grants-2013_01 · 10.6084/m9.figshare.5104873.v1 · US08349883B2

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