1-(2-phenylethyl)-4-(4-pyridyl)piperazine | 1228095-08-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 1-(2-phenylethyl)-4-(4-pyridyl)piperazine
• 英文别名: 1-(2-phenylethyl)-4-pyridin-4-ylpiperazine
• CAS: 1228095-08-6
• 化学式: C₁₇H₂₁N₃
• 分子量: 267.374
• InChiKey: PFKWURXXPIHLQK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  19.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-(2-phenylethyl)-4-(4-pyridyl)piperazine 、 草酸 以 甲醇 为溶剂， 生成
  参考文献：
  名称：

  The effect of the pyridyl nitrogen position in pyridylpiperazine sigma ligands

  摘要：

  A series of pyridylpiperazines was synthesized and analyzed for sigma receptor binding affinity to determine the optimal pyridyl nitrogen position and chain length for the sigma(1) and sigma(2) receptor recognition. The (3-pyridyl) piperazines and (4-pyridyl) piperazines favor sigma(1) receptors, while previously studied (2-pyridyl) piperazines favor sigma(2) receptors. (C) 2010 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2010.02.087
• 作为产物：
  描述：

  乙基溴苯 、 1-(4-吡啶基)哌嗪 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 1-(2-phenylethyl)-4-(4-pyridyl)piperazine
  参考文献：
  名称：

  The effect of the pyridyl nitrogen position in pyridylpiperazine sigma ligands

  摘要：

  A series of pyridylpiperazines was synthesized and analyzed for sigma receptor binding affinity to determine the optimal pyridyl nitrogen position and chain length for the sigma(1) and sigma(2) receptor recognition. The (3-pyridyl) piperazines and (4-pyridyl) piperazines favor sigma(1) receptors, while previously studied (2-pyridyl) piperazines favor sigma(2) receptors. (C) 2010 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2010.02.087

文献信息

• The effect of the pyridyl nitrogen position in pyridylpiperazine sigma ligands
  作者：Lidiya Stavitskaya、Michael J. Seminerio、Marilyn M. Matthews-Tsourounis、Rae R. Matsumoto、Andrew Coop

  DOI：10.1016/j.bmcl.2010.02.087

  日期：2010.4

  A series of pyridylpiperazines was synthesized and analyzed for sigma receptor binding affinity to determine the optimal pyridyl nitrogen position and chain length for the sigma(1) and sigma(2) receptor recognition. The (3-pyridyl) piperazines and (4-pyridyl) piperazines favor sigma(1) receptors, while previously studied (2-pyridyl) piperazines favor sigma(2) receptors. (C) 2010 Published by Elsevier Ltd.