HCID76901952

5-chloro-N-((2,6-dimethyl-4-oxo-1,4-dihydropyridin-3-yl)methyl)-2-methyl-3-((1-(pyrimidin-4-yl)piperidin-4-yl)oxy)benzamide

5-chloro-N-[(2,6-dimethyl-4-oxo-1H-pyridin-3-yl)methyl]-2-methyl-3-(1-pyrimidin-4-ylpiperidin-4-yl)oxybenzamide

C25H28ClN5O3482 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: Cc1cc(=O)c(CNC(=O)c2cc(Cl)cc(OC3CCN(c4ccncn4)CC3)c2C)c(C)[nH]1
InChIKey: NXSZOHUSULBUIS-UHFFFAOYSA-N
分子式: C25H28ClN5O3
平均分子量: 482 g/mol
单同位素质量: 481.1880675

COMPUTED

结构计算性质

已同步

XLogP: 4.2
极性表面积: 96.5 Å²
氢键供体: 2
氢键受体: 7
可旋转键: 6
重原子: 34
形式电荷: 0
复杂度: 823

ALIASES

名称与别名

共 4 条

SCHEMBL15865028NXSZOHUSULBUIS-UHFFFAOYSA-N5-chloro -N-((2,6-dimethyl-4-oxo-1,4-dihydropyridin-3-yl)methyl)-2-methyl-3-((1-(pyrimidin-4-yl)piperidin-4-yl)oxy)benzamide5-chloro-N-((2,6-dimethyl-4-oxo-1,4-dihydropyridin-3-yl)methyl)-2-methyl-3-((1-(pyrimidin-4-yl)piperidin-4-yl)oxy)benzamide

REACTIONS

参与反应

1 条

uspto-grants-2016_07 · 10.6084/m9.figshare.5104873.v1 · US09382234B2

查看