(Z)-N,N-dimethyl-4-((1-methyl-4-oxo-5-trityl-5,6-dihydro-1H-pyrrolo[3,2-c]pyridin-7(4H)-ylidene)methyl)-1H-imidazole-1-sulfonamide | 1269422-76-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• 英文名称: (Z)-N,N-dimethyl-4-((1-methyl-4-oxo-5-trityl-5,6-dihydro-1H-pyrrolo[3,2-c]pyridin-7(4H)-ylidene)methyl)-1H-imidazole-1-sulfonamide
• 英文别名: N,N-dimethyl-4-[(Z)-(1-methyl-4-oxo-5-trityl-6H-pyrrolo[3,2-c]pyridin-7-ylidene)methyl]imidazole-1-sulfonamide
• CAS: 1269422-76-5
• 化学式: C₃₃H₃₁N₅O₃S
• 分子量: 577.707
• InChiKey: RRCVUVDXWBIWAP-DAFNUICNSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  42
• 可旋转键数：
  7
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  88.8
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  N-(3-(1-(N,N-dimethylsulfamoyl)-1H-imidazol-4-yl)prop-2-ynyl)-1-methyl-N-trityl-1H-pyrrole-2-carboxamide 在 palladium diacetate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 24.0h， 以52%的产率得到(Z)-N,N-dimethyl-4-((1-methyl-4-oxo-5-trityl-5,6-dihydro-1H-pyrrolo[3,2-c]pyridin-7(4H)-ylidene)methyl)-1H-imidazole-1-sulfonamide
  参考文献：
  名称：

  Diversity-Oriented Approach to Pyrrole-Imidazole Alkaloid Frameworks

  摘要：

  An exploration of imidazolylpropargyl amides as linchpin synthons for the construction of a diverse array of heterocyclic frameworks, many of which are related to those found in the oroidin derived alkaloids, is described. One such intermediate has been used in a formal total synthesis of cyclooroidin.

  DOI：

  10.1021/ol200067e

文献信息

• Diversity-Oriented Approach to Pyrrole-Imidazole Alkaloid Frameworks
  作者：Manojkumar R. Bhandari、Muhammed Yousufuddin、Carl J. Lovely

  DOI：10.1021/ol200067e

  日期：2011.3.18

  An exploration of imidazolylpropargyl amides as linchpin synthons for the construction of a diverse array of heterocyclic frameworks, many of which are related to those found in the oroidin derived alkaloids, is described. One such intermediate has been used in a formal total synthesis of cyclooroidin.