HCID11619983

3-Cyano-N-((1S)-3-hydroxy-1-{[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methyl}propyl)-4-[(1-methylethyl)oxy]benzamide

3-cyano-N-[(2S)-4-hydroxy-1-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]butan-2-yl]-4-propan-2-yloxybenzamide

C29H30N4O3482.6 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1cccn2cc(-c3ccc(C[C@@H](CCO)NC(=O)c4ccc(OC(C)C)c(C#N)c4)cc3)nc12
InChIKey: OFXLDXQJVJZUIS-RUZDIDTESA-N
分子式: C29H30N4O3
平均分子量: 482.6 g/mol
单同位素质量: 482.23179083

COMPUTED

结构计算性质

已同步

XLogP: 5.3
极性表面积: 99.7 Å²
氢键供体: 2
氢键受体: 5
可旋转键: 9
重原子: 36
形式电荷: 0
复杂度: 759

ALIASES

名称与别名

共 4 条

CHEMBL5712053SCHEMBL2105059OFXLDXQJVJZUIS-RUZDIDTESA-N3-Cyano-N-((1S)-3-hydroxy-1-{[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methyl}propyl)-4-[(1-methylethyl)oxy]benzamide

REACTIONS