4-chloro-3-(4-nitrophenylsulfanyl)-N,4-diphenylbutanamide | 1420836-58-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-chloro-3-(4-nitrophenylsulfanyl)-N,4-diphenylbutanamide
• CAS: 1420836-58-3
• 化学式: C₂₂H₁₉ClN₂O₃S
• 分子量: 426.923
• InChiKey: XVWDROBJCZUBDU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.06
• 重原子数：
  29.0
• 可旋转键数：
  8.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  72.24
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  4-硝基苯亚磺酰氯 、 β-benzalpropionic acid anilide 以 氯仿 为溶剂， 反应 4.0h， 以78%的产率得到4-chloro-3-(4-nitrophenylsulfanyl)-N,4-diphenylbutanamide
  参考文献：
  名称：

  Intramolecular electrophilic cyclization of functional derivatives of unsaturated compounds: III. Reaction of N,4-Diarylbut-3-enamides with arenesulfenyl chlorides. Synthesis of 5-aryl-4-arylsulfanyl-2,3,4,5-tetrahydro-1H-1-benzazepin-2-ones

  摘要：

  N-Aryl-4-phenylbut-3-enamides reacted with arenesulfenyl chlorides in chloroform to give N,4-diaryl-3-arylsulfanyl-4-chlorobutanamides, whereas in acetic acid in the presence of lithium perchlorate N-[4-arylsulfanyl-5-phenyltetrahydrofuran-2-ylidene]arenaminium perchlorates were obtained. Reactions of arenesulfenyl chlorides with N,4-diarylbut-3-enamides having strong electron-donating groups in positions 3 and 4 of the N-aryl substituent afforded 5-aryl-4-arylsulfanyl-2,3,4,5-tetrahydro-1H-1-benzazepin-2-ones.

  DOI：

  10.1134/s107042801212007x