1-Piperidin-4-yl-azocane | 811461-86-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 1-Piperidin-4-yl-azocane
• 英文别名: 1-Piperidin-4-ylazocane
• CAS: 811461-86-6
• 化学式: C₁₂H₂₄N₂
• 分子量: 196.336
• InChiKey: JUSPAUIELVLQHE-UHFFFAOYSA-N

物化性质

• 沸点：
  277.8±8.0 °C(Predicted)
• 密度：
  0.938±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  15.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-氯-9H-吡啶并[3,4-b]吲哚 、 1-Piperidin-4-yl-azocane 以60%的产率得到1-(4-Azocan-1-yl-piperidin-1-yl)-9H-β-carboline
  参考文献：
  名称：

  Synthesis and biological studies of 1-amino β-carbolines

  摘要：

  A selection of 1-amino-substituted beta-carbolines have been prepared by amination of 1-chloro-beta-carboline as simple mimics of manzamine A and chloroquine and their intercalating ability, anticancer and antimalarial activity were studied. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.09.036
• 作为产物：
  描述：

  七亚甲基亚胺 在 titanium(IV) isopropylate 、 三氟乙酸 作用下， 反应 2.0h， 生成 1-Piperidin-4-yl-azocane
  参考文献：
  名称：

  Synthesis and biological studies of 1-amino β-carbolines

  摘要：

  A selection of 1-amino-substituted beta-carbolines have been prepared by amination of 1-chloro-beta-carboline as simple mimics of manzamine A and chloroquine and their intercalating ability, anticancer and antimalarial activity were studied. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.09.036

文献信息

• Synthesis and biological studies of 1-amino β-carbolines
  作者：Yohan Boursereau、Iain Coldham

  DOI：10.1016/j.bmcl.2004.09.036

  日期：2004.12

  A selection of 1-amino-substituted beta-carbolines have been prepared by amination of 1-chloro-beta-carboline as simple mimics of manzamine A and chloroquine and their intercalating ability, anticancer and antimalarial activity were studied. (C) 2004 Elsevier Ltd. All rights reserved.