uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09174986B2
查看![tert-butyl 4-(4-(3-(3-methoxy-4-((6-methoxypyridin-3-yl)methoxy)benzyl)-3H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazol-1-yl)piperidine-1-carboxylate 分子结构式](/api/mol/118114193/svg/360x280.svg)
HCID118114193
tert-butyl 4-(4-(3-(3-methoxy-4-((6-methoxypyridin-3-yl)methoxy)benzyl)-3H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazol-1-yl)piperidine-1-carboxylate
tert-butyl 4-[4-[3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridin-6-yl]pyrazol-1-yl]piperidine-1-carboxylate
C34H39N7O5625.7 g/mol
IDENTITY
结构与身份
- 标准SMILES
- COc1ccc(COc2ccc(Cn3cnc4cc(-c5cnn(C6CCN(C(=O)OC(C)(C)C)CC6)c5)cnc43)cc2OC)cn1
- InChIKey
- JVCIACBYALMBNR-UHFFFAOYSA-N
- 分子式
- C34H39N7O5
- 平均分子量
- 625.7 g/mol
- 单同位素质量
- 625.30126737
COMPUTED
结构计算性质
- XLogP
- 4.2
- 极性表面积
- 119 Ų
- 氢键供体
- 0
- 氢键受体
- 9
- 可旋转键
- 11
- 重原子
- 46
- 形式电荷
- 0
- 复杂度
- 978
ALIASES
名称与别名
SCHEMBL16763243JVCIACBYALMBNR-UHFFFAOYSA-Ntert-butyl 4-(4-(3-(3-methoxy-4-((6-methoxypyridin-3-yl)methoxy)benzyl)-3H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazol-1-yl)piperidine-1-carboxylate
REACTIONS
