2-(diphenylphosphinoyl)-6-oxocyclohexylcarbothioic acid phenylamide | 1347761-54-9

• 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: 2-(diphenylphosphinoyl)-6-oxocyclohexylcarbothioic acid phenylamide
• 英文别名: 2-diphenylphosphoryl-6-oxo-N-phenylcyclohexane-1-carbothioamide
• CAS: 1347761-54-9
• 化学式: C₂₅H₂₄NO₂PS
• 分子量: 433.511
• InChiKey: YUISEEVHPZJYGL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  30
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  78.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(diphenylphosphinoyl)-6-oxocyclohexylcarbothioic acid phenylamide 在 肼 作用下， 以 氯仿 为溶剂， 反应 24.0h， 以74%的产率得到[4-(diphenylphosphinoyl)-4,5,6,7-tetrahydro-2H-indazol-3-yl]phenylamine
  参考文献：
  名称：

  Efficient synthesis of 4-phosphinoyl-4,5,6,7-tetrahydro-2H-indazol-3-ylamines

  摘要：

  We described in this paper an efficient synthesis of variously substituted 4-phosphinoyl-4,5,6,7-tetrahydro-2H-indazol-3-ylamines involving nucleophilic addition of hydrazine on beta-ketothioamides as key-step. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.09.093
• 作为产物：
  描述：

  2-环己烯-1-酮 在 potassium tert-butylate 、 溶剂黄146 作用下， 以 四氢呋喃 为溶剂， 反应 20.0h， 生成 2-(diphenylphosphinoyl)-6-oxocyclohexylcarbothioic acid phenylamide
  参考文献：
  名称：

  Efficient synthesis of 4-phosphinoyl-4,5,6,7-tetrahydro-2H-indazol-3-ylamines

  摘要：

  We described in this paper an efficient synthesis of variously substituted 4-phosphinoyl-4,5,6,7-tetrahydro-2H-indazol-3-ylamines involving nucleophilic addition of hydrazine on beta-ketothioamides as key-step. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.09.093

文献信息

• Efficient synthesis of 4-phosphinoyl-4,5,6,7-tetrahydro-2H-indazol-3-ylamines
  作者：Nourchaine Jelaiel、Corinne Comoy、Brigitte Fernette、Mohamed Lofti Efrit、Yves Fort

  DOI：10.1016/j.tet.2011.09.093

  日期：2011.12

  We described in this paper an efficient synthesis of variously substituted 4-phosphinoyl-4,5,6,7-tetrahydro-2H-indazol-3-ylamines involving nucleophilic addition of hydrazine on beta-ketothioamides as key-step. (C) 2011 Elsevier Ltd. All rights reserved.