HCID66711445

1-Methyl-4-[1-(4-nitro-phenyl)-piperidin-3-ylmethyl]-piperazine

1-methyl-4-[[1-(4-nitrophenyl)piperidin-3-yl]methyl]piperazine

C17H26N4O2318.4 g/molCAS 1233093-92-9

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IDENTITY

结构与身份

标准SMILES: CN1CCN(CC2CCCN(c3ccc([N+](=O)[O-])cc3)C2)CC1
InChIKey: HIWOIHZLQMCUSD-UHFFFAOYSA-N
分子式: C17H26N4O2
平均分子量: 318.4 g/mol
单同位素质量: 318.20557608

COMPUTED

结构计算性质

已同步

XLogP: 2.5
极性表面积: 55.5 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 3
重原子: 23
形式电荷: 0
复杂度: 385

ALIASES

名称与别名

共 9 条

1233093-92-91-Methyl-4-((1-(4-nitrophenyl)piperidin-3-yl)methyl)piperazine1-Methyl-4-{[1-(4-nitrophenyl)piperidin-3-yl]methyl}piperazineSCHEMBL520304HIWOIHZLQMCUSD-UHFFFAOYSA-NDTXSID201176626DB-1476731-Methyl-4-[[1-(4-nitrophenyl)-3-piperidinyl]methyl]piperazine1-Methyl-4-[1-(4-nitro-phenyl)-piperidin-3-ylmethyl]-piperazine

REACTIONS

参与反应

4 条

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-2013_06 · 10.6084/m9.figshare.5104873.v1 · US08471005B2

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uspto-grants-2013_06 · 10.6084/m9.figshare.5104873.v1 · US08471005B2

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uspto-grants-2013_06 · 10.6084/m9.figshare.5104873.v1 · US08471005B2

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