uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08536179B2
查看HCID53492738
1-cyclopentyl-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-3-methyl-6-(6-(piperazin-1-yl)pyridin-3-yl)-1H-indole-4-carboxamide
1-cyclopentyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-methyl-6-(6-piperazin-1-yl-3-pyridinyl)indole-4-carboxamide
C32H38N6O2538.7 g/mol
IDENTITY
结构与身份
- 标准SMILES
- Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(N4CCNCC4)nc3)cc3c2c(C)cn3C2CCCC2)c(=O)[nH]1
- InChIKey
- KYJKBFVZEZKSDX-UHFFFAOYSA-N
- 分子式
- C32H38N6O2
- 平均分子量
- 538.7 g/mol
- 单同位素质量
- 538.30562448
COMPUTED
结构计算性质
- XLogP
- 3.8
- 极性表面积
- 91.3 Ų
- 氢键供体
- 3
- 氢键受体
- 5
- 可旋转键
- 6
- 重原子
- 40
- 形式电荷
- 0
- 复杂度
- 1,010
物化、安全与法规信息正在同步。
ALIASES
名称与别名
SCHEMBL2593824KYJKBFVZEZKSDX-UHFFFAOYSA-N1-cyclopentyl-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-3-methyl-6-(6-(piperazin-1-yl)pyridin-3-yl)-1H-indole-4-carboxamide
REACTIONS
参与反应
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