HCID22640927

N-[2-hydroxy-3-(3-chloro-5-methoxy-phenoxy)propyl]-1,1-dimethyl-2-(4-methoxyphenyl)ethylamine Hydrochloride

1-(3-chloro-5-methoxyphenoxy)-3-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]propan-2-ol;hydrochloride

C21H29Cl2NO4430.4 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1ccc(CC(C)(C)NCC(O)COc2cc(Cl)cc(OC)c2)cc1.Cl
InChIKey: NBZNIDQOFYUEGK-UHFFFAOYSA-N
分子式: C21H29Cl2NO4
平均分子量: 430.4 g/mol
单同位素质量: 429.1473638

COMPUTED

结构计算性质

已同步

极性表面积: 60 Å²
氢键供体: 3
氢键受体: 5
可旋转键: 10
重原子: 28
形式电荷: 0
复杂度: 415

ALIASES

名称与别名

共 4 条

SCHEMBL5514578NBZNIDQOFYUEGK-UHFFFAOYSA-NN-[2-hydroxy-3-(3-chloro-5-methoxy-phenoxy)propyl]-1,1-dimethyl-2-(4-methoxyphenyl)ethylamine HydrochlorideN-[2-hydroxy-3-(3-chloro-5-methoxyphenoxy)propyl]-1,1-dimethyl-2-(4-methoxyphenyl)ethylamine Hydrochloride

REACTIONS