(Z)-methyl 2-((1H-indol-3-yl)(p-iso-propylphenyl)methyl)-3-(p-methlyphenylamino)acrylate | 1415507-20-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: (Z)-methyl 2-((1H-indol-3-yl)(p-iso-propylphenyl)methyl)-3-(p-methlyphenylamino)acrylate
• 英文别名: methyl (Z)-2-[1H-indol-3-yl-(4-propan-2-ylphenyl)methyl]-3-(4-methylanilino)prop-2-enoate
• CAS: 1415507-20-8
• 化学式: C₂₉H₃₀N₂O₂
• 分子量: 438.569
• InChiKey: SUWFIIVYUSLVIT-ITYLOYPMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.5
• 重原子数：
  33
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  54.1
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  乙烷,三氯氟- 在 iron(III) chloride 作用下， 以 乙醇 为溶剂， 反应 30.0h， 生成 (Z)-methyl 2-((1H-indol-3-yl)(p-iso-propylphenyl)methyl)-3-(p-methlyphenylamino)acrylate
  参考文献：
  名称：

  Domino reaction of arylamine, methyl propiolate, aromatic aldehyde, and indole for facile synthesis of functionalized indol-3-yl acrylates

  摘要：

  In the presence of FeCl3 as catalyst the one-pot domino reactions of arylamines, methyl propiolate, aromatic aldehydes, and indole in ethanol at room temperature proceeded smoothly to give methyl 2-(1H-indol-3-yl)arylmethyl-3-arylamino)acrylates in good yields. H-1 NMR spectra and single crystal structures indicated that (Z)-acrylates were stereoselectively formed in the reactions. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.10.043

文献信息

• Domino reaction of arylamine, methyl propiolate, aromatic aldehyde, and indole for facile synthesis of functionalized indol-3-yl acrylates
  作者：Li-Li Zhang、Jing Sun、Chao-Guo Yan

  DOI：10.1016/j.tetlet.2012.10.043

  日期：2012.12

  In the presence of FeCl3 as catalyst the one-pot domino reactions of arylamines, methyl propiolate, aromatic aldehydes, and indole in ethanol at room temperature proceeded smoothly to give methyl 2-(1H-indol-3-yl)arylmethyl-3-arylamino)acrylates in good yields. H-1 NMR spectra and single crystal structures indicated that (Z)-acrylates were stereoselectively formed in the reactions. (C) 2012 Elsevier Ltd. All rights reserved.