| 1247734-58-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• CAS: 1247734-58-2
• 化学式: C₃₀H₄₄N₄O₂Si
• 分子量: 520.79
• InChiKey: SWIXQXJUADJIDS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.31
• 重原子数：
  37.0
• 可旋转键数：
  10.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  50.6
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  在 lithium aluminium tetrahydride 作用下， 以 四氢呋喃 为溶剂， 反应 0.17h， 生成
  参考文献：
  名称：

  2-Substituted N-aryl piperazines as novel triple reuptake inhibitors for the treatment of depression

  摘要：

  Recently a class of compounds known as triple reuptake inhibitors has emerged as a new strategy for the treatment of depression. These compounds work by simultaneously inhibiting the synaptic reuptake of serotonin, norepinephrine and dopamine. In this Letter we describe the optimization of a novel series of 2-substituted N-aryl piperazine based triple reuptake inhibitors. (c) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.05.008
• 作为产物：
  描述：

  1-benzyl-4-(1-triisopropylsilanyl-1H-indazol-5-yl)-piperazin-2-one 、 2-溴乙基甲基醚 在 仲丁基锂 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  2-Substituted N-aryl piperazines as novel triple reuptake inhibitors for the treatment of depression

  摘要：

  Recently a class of compounds known as triple reuptake inhibitors has emerged as a new strategy for the treatment of depression. These compounds work by simultaneously inhibiting the synaptic reuptake of serotonin, norepinephrine and dopamine. In this Letter we describe the optimization of a novel series of 2-substituted N-aryl piperazine based triple reuptake inhibitors. (c) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.05.008