| 1332647-03-6

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• CAS: 1332647-03-6
• 化学式: C₃₁H₃₂IN₃O₂
• 分子量: 605.518
• InChiKey: RVYVSUWOKDHIBW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.93
• 重原子数：
  37.0
• 可旋转键数：
  6.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  52.65
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  、 苯胺 在 palladium diacetate 、 caesium carbonate 、 R-(+)-1,1'-联萘-2,2'-双二苯膦 作用下， 以 甲苯 为溶剂， 反应 7.0h， 以79%的产率得到2-((Z)-3-(phenylamino(phenyl)methylene)-2-oxoindolin-1-yl)-N-cyclohexyl-2-(4-(dimethylamino)phenyl)-acetamide
  参考文献：
  名称：

  Palladium catalyzed stereoselective synthesis of 3-(anilinoarylmethylene)-2-oxindoles as Hesperadin analogoues

  摘要：

  Potentially bioactive 3-(anilinoarylmethylene)-2-oxindoles as Hesperadin analogoues have been synthesized via a two-step procedure: (a) an Ugi-4MCR and (b) reaction of the Ugi adduct with aniline in the presence of a palladium catalyst via domino Heck/Buchwald reaction. In all cases, a single isomer with the Z-configuration was obtained in good to high yields. Crown Copyright (C) 2011 Published by Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.02.005
• 作为产物：
  描述：

  异氰环已烷 、 2-碘苯胺 、 对二甲氨基苯甲醛 、 苯丙炔酸 以 甲醇 为溶剂， 反应 24.75h， 生成
  参考文献：
  名称：

  Palladium catalyzed stereoselective synthesis of 3-(anilinoarylmethylene)-2-oxindoles as Hesperadin analogoues

  摘要：

  Potentially bioactive 3-(anilinoarylmethylene)-2-oxindoles as Hesperadin analogoues have been synthesized via a two-step procedure: (a) an Ugi-4MCR and (b) reaction of the Ugi adduct with aniline in the presence of a palladium catalyst via domino Heck/Buchwald reaction. In all cases, a single isomer with the Z-configuration was obtained in good to high yields. Crown Copyright (C) 2011 Published by Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.02.005

文献信息

• Palladium-catalyzed stereoselective synthesis of 3-(aminomethylene)-oxindoles
  作者：Morteza Bararjanian、Saeedeh Hosseinzadeh、Saeed Balalaie、Hamid Reza Bijanzadeh、Eckardt Wolf

  DOI：10.1016/j.tetlet.2011.04.071

  日期：2011.6

  An efficient palladium-catalyzed protocol for the stereoselective synthesis of 3-(aminoarylmethylene)-oxindoles has been developed. In this approach, Ugi-4-component reaction adducts were used as starting materials for carbopalladative cyclization-Buchwald reaction sequences. (C) 2011 Published by Elsevier Ltd.