HCID67217756

(5-Aminomethyl-1,3,4-oxadiazol-2-yl)-[4-(1-methyl-piperidin-4-ylmethyl)-piperazin-1-yl]-methanone trihydrochloride

[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]-[4-[(1-methylpiperidin-4-yl)methyl]piperazin-1-yl]methanone;trihydrochloride

C15H29Cl3N6O2431.8 g/mol

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: CN1CCC(CN2CCN(C(=O)c3nnc(CN)o3)CC2)CC1.Cl.Cl.Cl
InChIKey: LDMDIGWRRVEIBC-UHFFFAOYSA-N
分子式: C15H29Cl3N6O2
平均分子量: 431.8 g/mol
单同位素质量: 430.141757

COMPUTED

结构计算性质

已同步

极性表面积: 91.7 Å²
氢键供体: 4
氢键受体: 7
可旋转键: 4
重原子: 26
形式电荷: 0
复杂度: 393

ALIASES

名称与别名

共 4 条

SCHEMBL1936581LDMDIGWRRVEIBC-UHFFFAOYSA-N(5-Amino methyl-1,3,4-oxadiazol-2-yl)-[4-(1-methyl-piperidin-4-ylmethyl)-piperazin-1-yl]-methanone trihydrochloride(5-Aminomethyl-1,3,4-oxadiazol-2-yl)-[4-(1-methyl-piperidin-4-ylmethyl)-piperazin-1-yl]-methanone trihydrochloride

REACTIONS