2-<3-(4-Methyl-piperazino)-propyl>-benztriazol | 2651-30-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并三唑类
• 英文名称: 2-<3-(4-Methyl-piperazino)-propyl>-benztriazol
• 英文别名: 2-[3-(4-methyl-piperazin-1-yl)-propyl]-2H-benzotriazole；2-[3-(4-Methylpiperazin-1-yl)propyl]benzotriazole
• CAS: 2651-30-1
• 化学式: C₁₄H₂₁N₅
• 分子量: 259.354
• InChiKey: AWXQHRCJOVLADE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  37.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  N-甲基哌嗪 在 sodium ethanolate 作用下， 以 乙醇 、 甲苯 为溶剂， 反应 5.0h， 生成 2-<3-(4-Methyl-piperazino)-propyl>-benztriazol
  参考文献：
  名称：

  Synthesis and trazodone-like pharmacological profile of 1- and 2-[3-[4-(X)-1-piperazinyl]-propyl]-benzotriazoles

  摘要：

  A series of 1- and 2-[3-[4-(X)-1-piperazinyl]-propyl]benzotriazoles were prepared and evaluated for their trazodone like pharmacological profile; as preliminary pharmacological screening, the compounds were tested for their antiserotonergic, antiadrenergic and antihistaminic in vitro activity as well as for their analgesic in vivo action. Structure-activity relationships showed that among the synthesized compounds, the analogues bearing on the 4-piperazine nitrogen either an unsubstituted phenyl ring or a 2- or 3-chloro phenyl moiety show a pharmacological profile similar to that of the antidepressant trazodone.

  DOI：

  10.1016/0223-5234(93)90053-h