HCID67321455

1-(4-methoxybutyl)-N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholin-4-ylcarbonyl)piperidin-3-yl]-1H-indole-2-carboxamide hydrochloride

1-(4-methoxybutyl)-N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholine-4-carbonyl)piperidin-3-yl]indole-2-carboxamide;hydrochloride

C28H43ClN4O4535.1 g/mol

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IDENTITY

结构与身份

标准SMILES: COCCCCn1c(C(=O)N(CC(C)C)[C@@H]2CNC[C@H](C(=O)N3CCOCC3)C2)cc2ccccc21.Cl
InChIKey: POHPTYAFDUEGDE-ITNPDYSASA-N
分子式: C28H43ClN4O4
平均分子量: 535.1 g/mol
单同位素质量: 534.2972836

COMPUTED

结构计算性质

已同步

极性表面积: 76 Å²
氢键供体: 2
氢键受体: 5
可旋转键: 10
重原子: 37
形式电荷: 0
复杂度: 714

ALIASES

名称与别名

共 3 条

SCHEMBL2220094POHPTYAFDUEGDE-ITNPDYSASA-N1-(4-methoxybutyl)-N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholin-4-ylcarbonyl)piperidin-3-yl]-1H-indole-2-carboxamide hydrochloride

REACTIONS

参与反应

4 条

uspto-grants-2014_03 · 10.6084/m9.figshare.5104873.v1 · US08664380B2

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uspto-grants-2013_06 · 10.6084/m9.figshare.5104873.v1 · US08466282B2

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uspto-grants-2015_12 · 10.6084/m9.figshare.5104873.v1 · US09221836B2

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uspto-grants-2015_06 · 10.6084/m9.figshare.5104873.v1 · US09045436B2

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