(E)-3-(4-chlorophenyl)-7-(4-chlorostyryl)-5,6-di(1,3-dithiolan-2-ylidene)-7-hydroxy-6,7-dihydro-1H-indol-4(5H)-one | 1610966-97-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: (E)-3-(4-chlorophenyl)-7-(4-chlorostyryl)-5,6-di(1,3-dithiolan-2-ylidene)-7-hydroxy-6,7-dihydro-1H-indol-4(5H)-one
• 英文别名: 3-(4-chlorophenyl)-7-[(E)-2-(4-chlorophenyl)ethenyl]-5,6-bis(1,3-dithiolan-2-ylidene)-7-hydroxy-1H-indol-4-one
• CAS: 1610966-97-6
• 化学式: C₂₈H₂₁Cl₂NO₂S₄
• 分子量: 602.65
• InChiKey: GLVOFGLLKHJYMW-MDZDMXLPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.7
• 重原子数：
  37
• 可旋转键数：
  3
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  154
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  对甲基苯磺酰甲基异腈 、 (1E,7E)-1,8-bis(4-chlorophenyl)-4,5-di(1,3-dithiolan-2-ylidene)-octa-1,7-diene-3,6-dione 在 sodium hydroxide 作用下， 以 四氢呋喃 为溶剂， 以95%的产率得到(E)-3-(4-chlorophenyl)-7-(4-chlorostyryl)-5,6-di(1,3-dithiolan-2-ylidene)-7-hydroxy-6,7-dihydro-1H-indol-4(5H)-one
  参考文献：
  名称：

  Bicyclization of Isocyanides with Alkenoyl Bis(ketene dithioacetals): Access to 6,7-Dihydro-1H-indol-4(5H)-ones

  摘要：

  The tandem [3 + 2] cycloaddition/intramolecular imidoyl anion trapping strategy has been successfully applied for the synthesis of 6,7-dihydro-1H-indol-4(5H)-ones from alkenoyl bis(ketene dithioacetals) and tosylmethyl isocyanide. The reaction proceeded smoothly under mild reaction conditions to afford bicyclization products in high to excellent yields in a single step.

  DOI：

  10.1021/jo500928c

文献信息

• Bicyclization of Isocyanides with Alkenoyl Bis(ketene dithioacetals): Access to 6,7-Dihydro-1<i>H</i>-indol-4(5<i>H</i>)-ones
  作者：Yifei Li、Xianxiu Xu、Hui Shi、Ling Pan、Qun Liu

  DOI：10.1021/jo500928c

  日期：2014.6.20

  The tandem [3 + 2] cycloaddition/intramolecular imidoyl anion trapping strategy has been successfully applied for the synthesis of 6,7-dihydro-1H-indol-4(5H)-ones from alkenoyl bis(ketene dithioacetals) and tosylmethyl isocyanide. The reaction proceeded smoothly under mild reaction conditions to afford bicyclization products in high to excellent yields in a single step.