3-(2-(indol-1-yl)ethyl)pyrrolidine-2-thione | 166535-71-3

• 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: 3-(2-(indol-1-yl)ethyl)pyrrolidine-2-thione
• 英文别名: 3-(2-(indol-1-yl)ethyl)piperidine-2-thione；3-(2-indol-1-ylethyl)pyrrolidine-2-thione
• CAS: 166535-71-3
• 化学式: C₁₄H₁₆N₂S
• 分子量: 244.36
• InChiKey: JYEQKOXVUYCDPS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.97
• 重原子数：
  17.0
• 可旋转键数：
  3.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  16.96
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  dibromomalonyl dichloride 、 3-(2-(indol-1-yl)ethyl)pyrrolidine-2-thione 在 锌 作用下， 以 乙醚 为溶剂， 反应 16.0h， 以100%的产率得到8-(2-(indol-1-yl)ethyl)-3,4,6,7-tetrahydro-2H-pyrrolo<2,1-b><1,3>thiazine-2,4-dione
  参考文献：
  名称：

  8H-Anhydro-4-hydroxy-2-oxo-1,3-thiazinium Hydroxides as Mesoionic 1,4-Dipoles

  摘要：

  The previously unknown 8H-anhydro-4-hydroxy-2-oxo-1,3-thiazinium hydroxides (1) were prepared and their 1,4-dipolar cycloaddition behavior was examined. In most cases, elimination of the proton in the 8-position of the mesoionic ring was observed to occur unless extremely reactive dipolarophiles were used. The S,N-ketene acetals were converted to the corresponding alpha-diazo ketones for further study.

  DOI：

  10.3987/com-93-s(b)16-1
• 作为产物：
  描述：

  3-(2-(indol-1-yl)ethyl)pyrrolidin-2-one 在 劳森试剂 作用下， 以 甲苯 为溶剂， 反应 0.5h， 以22%的产率得到3-(2-(indol-1-yl)ethyl)pyrrolidine-2-thione
  参考文献：
  名称：

  8H-Anhydro-4-hydroxy-2-oxo-1,3-thiazinium Hydroxides as Mesoionic 1,4-Dipoles

  摘要：

  The previously unknown 8H-anhydro-4-hydroxy-2-oxo-1,3-thiazinium hydroxides (1) were prepared and their 1,4-dipolar cycloaddition behavior was examined. In most cases, elimination of the proton in the 8-position of the mesoionic ring was observed to occur unless extremely reactive dipolarophiles were used. The S,N-ketene acetals were converted to the corresponding alpha-diazo ketones for further study.

  DOI：

  10.3987/com-93-s(b)16