HCID86663827

9-Ethyl-8-(4-hydroxyimino-piperidin-1-yl)-6,6-dimethyl-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile

9-ethyl-8-(4-hydroxyiminopiperidin-1-yl)-6,6-dimethyl-11-oxo-5H-benzo[b]carbazole-3-carbonitrile

C26H26N4O2426.5 g/mol

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IDENTITY

结构与身份

标准SMILES: CCc1cc2c(cc1N1CCC(=NO)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O
InChIKey: WGQWZMRBJXOQEO-UHFFFAOYSA-N
分子式: C26H26N4O2
平均分子量: 426.5 g/mol
单同位素质量: 426.20557608

COMPUTED

结构计算性质

已同步

XLogP: 4.7
极性表面积: 92.5 Å²
氢键供体: 2
氢键受体: 5
可旋转键: 2
重原子: 32
形式电荷: 0
复杂度: 819

ALIASES

名称与别名

共 3 条

SCHEMBL897673WGQWZMRBJXOQEO-UHFFFAOYSA-N9-Ethyl-8-(4-hydroxyimino-piperidin-1-yl)-6,6-dimethyl-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile

REACTIONS

参与反应

2 条

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440922B2

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uspto-grants-2015_09 · 10.6084/m9.figshare.5104873.v1 · US09126931B2

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