2-(4-chlorobenzyl)-5-(4-chlorophenyl)-1-phenyl-3-p-tolyl-1H-pyrrole | 1126271-44-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 2-(4-chlorobenzyl)-5-(4-chlorophenyl)-1-phenyl-3-p-tolyl-1H-pyrrole
• 英文别名: 5-(4-Chlorophenyl)-2-[(4-chlorophenyl)methyl]-3-(4-methylphenyl)-1-phenylpyrrole
• CAS: 1126271-44-0
• 化学式: C₃₀H₂₃Cl₂N
• 分子量: 468.425
• InChiKey: QYNDSFKGRRZFLN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.2
• 重原子数：
  33
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  4.9
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  [(Z)-1,5-bis(4-chlorophenyl)-3-(4-methylphenyl)pent-2-en-4-ynyl] acetate 、 苯胺 在 potassium chloride 、 palladium dichloride 作用下， 以 水 、 乙腈 为溶剂， 反应 12.0h， 以92%的产率得到2-(4-chlorobenzyl)-5-(4-chlorophenyl)-1-phenyl-3-p-tolyl-1H-pyrrole
  参考文献：
  名称：

  Efficient synthesis of highly substituted pyrroles based on the tandem reactions: intermolecular amination and Pd(II)-catalyzed intramolecular hydroamidation

  摘要：

  A novel and efficient method for construction of polysubstituted pyrroles, which included an intermolecular amination and Pd(II)-catalyzed intramolecular hydroamidation, was developed. It was found that the reactions gave high yields (55-92%). Crown Copyright (C) 2008 Published by Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.12.018

文献信息

• Efficient synthesis of highly substituted pyrroles based on the tandem reactions: intermolecular amination and Pd(II)-catalyzed intramolecular hydroamidation
  作者：Yong-Jiang Bian、Xue-Yuan Liu、Ke-Gong Ji、Xing-Zhong Shu、Li-Na Guo、Yong-Min Liang

  DOI：10.1016/j.tet.2008.12.018

  日期：2009.2

  A novel and efficient method for construction of polysubstituted pyrroles, which included an intermolecular amination and Pd(II)-catalyzed intramolecular hydroamidation, was developed. It was found that the reactions gave high yields (55-92%). Crown Copyright (C) 2008 Published by Elsevier Ltd. All rights reserved.