[2-(1H-Indol-3-yl)-ethyl]-methylene-amine | 298711-99-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: [2-(1H-Indol-3-yl)-ethyl]-methylene-amine
• 英文别名: Methylenetryptamine；N-[2-(1H-indol-3-yl)ethyl]methanimine
• CAS: 298711-99-6
• 化学式: C₁₁H₁₂N₂
• 分子量: 172.23
• InChiKey: QZJOXANWFXLULI-UHFFFAOYSA-N

物化性质

• 沸点：
  359.4±44.0 °C(Predicted)
• 密度：
  1.06±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  28.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  [2-(1H-Indol-3-yl)-ethyl]-methylene-amine 在 盐酸 作用下， 以 乙醚 为溶剂， 生成 1,2,3,4-四氢去甲哈尔满盐酸盐
  参考文献：
  名称：

  Synthesis and activity of β-carboline antimalarials targeting the Plasmodium falciparum heat shock 90 protein

  摘要：

  DOI：

  10.1016/j.bmcl.2023.129410
• 作为产物：
  描述：

  聚合甲醛 、 色胺 以 二氯甲烷 为溶剂， 生成 [2-(1H-Indol-3-yl)-ethyl]-methylene-amine
  参考文献：
  名称：

  One-pot synthesis and biological evaluation of aspergillamides and analogues

  摘要：

  A one-pot total synthesis of aspergillamide and analogues by a solution phase Ugi multi component reaction (MCR) is described. The reaction is easily performed in 96-well plates and offers a facile access to diverse aspergillamide analogue compound libraries. The antibiotic and cytotoxic activity of these compounds is measured. Several of them are more potent than the natural product. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00305-x

文献信息

• One-pot synthesis and biological evaluation of aspergillamides and analogues
  作者：Barbara Beck、Sibylle Hess、Alexander Dömling

  DOI：10.1016/s0960-894x(00)00305-x

  日期：2000.8

  A one-pot total synthesis of aspergillamide and analogues by a solution phase Ugi multi component reaction (MCR) is described. The reaction is easily performed in 96-well plates and offers a facile access to diverse aspergillamide analogue compound libraries. The antibiotic and cytotoxic activity of these compounds is measured. Several of them are more potent than the natural product. (C) 2000 Elsevier Science Ltd. All rights reserved.
• Synthesis and activity of β-carboline antimalarials targeting the Plasmodium falciparum heat shock 90 protein
  作者：Neil K. Viswanathan、Michael E. Chirgwin、Julia Gibbs、Brianna N. Kalaj、Sierra Durham、Jennifer Tran、Maximillian Gomez、Horacio Lazaro、Ming Chen、Christopher R. Mansfield、Emily R. Derbyshire、Scott Eagon

  DOI：10.1016/j.bmcl.2023.129410

  日期：2023.8