HCID67539044

1-(2-(4-((2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino)piperidin-1-yl)ethyl)-7-methoxy-3,4-dihydroquinolin-2(1H)-one hydrochloride

1-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)piperidin-1-yl]ethyl]-7-methoxy-3,4-dihydroquinolin-2-one;hydrochloride

C26H34ClN3O4488 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1ccc2c(c1)N(CCN1CCC(NCc3ccc4c(c3)OCCO4)CC1)C(=O)CC2.Cl
InChIKey: WJTSNDOEFMNJEA-UHFFFAOYSA-N
分子式: C26H34ClN3O4
平均分子量: 488 g/mol
单同位素质量: 487.2237843

COMPUTED

结构计算性质

已同步

极性表面积: 63.3 Å²
氢键供体: 2
氢键受体: 6
可旋转键: 7
重原子: 34
形式电荷: 0
复杂度: 641

ALIASES

名称与别名

共 3 条

SCHEMBL2797448WJTSNDOEFMNJEA-UHFFFAOYSA-N1-(2-(4-((2,3-dihydro-1,4-benzodioxin-6-ylmethyl)amino)piperidin-1-yl)ethyl)-7-methoxy-3,4-dihydroquinolin-2(1H)-one hydrochloride

REACTIONS

参与反应

2 条

uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08524738B2

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uspto-grants-2012_12 · 10.6084/m9.figshare.5104873.v1 · US08329694B2

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