HCID54771321

1,7-dimethyl-3-{4-[(3-methyl-3H-imidazo[4,5-b]pyridin-2-yl)oxy]phenyl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

1,7-dimethyl-3-[4-(3-methylimidazo[4,5-b]pyridin-2-yl)oxyphenyl]imidazo[4,5-b]pyridin-2-one

C21H18N6O2386.4 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1ccnc2c1n(C)c(=O)n2-c1ccc(Oc2nc3cccnc3n2C)cc1
InChIKey: ADFSTLRRHDHJAP-UHFFFAOYSA-N
分子式: C21H18N6O2
平均分子量: 386.4 g/mol
单同位素质量: 386.14912384

COMPUTED

结构计算性质

等待补全

XLogP: 2.8
极性表面积: 76.4 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 3
重原子: 29
形式电荷: 0
复杂度: 612

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 3 条

SCHEMBL1699325ADFSTLRRHDHJAP-UHFFFAOYSA-N1,7-dimethyl-3-{4-[(3-methyl-3H-imidazo[4,5-b]pyridin-2-yl)oxy]phenyl}-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

REACTIONS

参与反应

4 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846713B2

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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uspto-grants-2016_01 · 10.6084/m9.figshare.5104873.v1 · US09226921B2

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uspto-grants-2013_10 · 10.6084/m9.figshare.5104873.v1 · US08563575B2

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