2,3,4,9-tetrahydro-1-methyl-1-(2-pyridinyl)-1H-pyrido-[3,4-b]indole hydrochloride | 1171890-11-1

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 哈马拉生物碱
• 英文名称: 2,3,4,9-tetrahydro-1-methyl-1-(2-pyridinyl)-1H-pyrido-[3,4-b]indole hydrochloride
• 英文别名: 2,3,4,9-Tetrahydro-1-methyl-1-(2-pyridinyl)-1h-pyrido[3,4-b]indole hydrochloride；1-methyl-1-pyridin-2-yl-2,3,4,9-tetrahydropyrido[3,4-b]indole;hydrochloride
• CAS: 1171890-11-1
• 化学式: C₁₇H₁₇N₃*ClH
• 分子量: 299.803
• InChiKey: YFFCWCAXSHHEDO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.39
• 重原子数：
  21
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  40.7
• 氢给体数：
  3
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-乙酰基吡啶 、 色胺 在 吡啶 、 三甲基氯硅烷 作用下， 反应 10.0h， 以78%的产率得到2,3,4,9-tetrahydro-1-methyl-1-(2-pyridinyl)-1H-pyrido-[3,4-b]indole hydrochloride
  参考文献：
  名称：

  Application of chlorotrimethylsilane in Pictet–Spengler reaction

  摘要：

  Chlorotrimethylsilane has been found to be an efficient condensing agent in the Pictet-Spengler reaction, affording an extremely straightforward synthetic route to tetrahydro-beta-carboline derivatives and their analogs. The applicability of the method has been studied, and a representative library of structurally diverse products has been created..

  DOI：

  10.1007/s00706-012-0804-7

文献信息

• Application of chlorotrimethylsilane in Pictet–Spengler reaction
  作者：Sergey V. Ryabukhin、Dmitriy M. Panov、Andrey S. Plaskon、Andrey A. Tolmachev、Radomyr V. Smaliy

  DOI：10.1007/s00706-012-0804-7

  日期：2012.11

  Chlorotrimethylsilane has been found to be an efficient condensing agent in the Pictet-Spengler reaction, affording an extremely straightforward synthetic route to tetrahydro-beta-carboline derivatives and their analogs. The applicability of the method has been studied, and a representative library of structurally diverse products has been created..