5-chloro-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid diallylamide | 1041697-42-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 5-chloro-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid diallylamide
• 英文别名: 5-chloro-N,N-bis(prop-2-enyl)-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
• CAS: 1041697-42-0
• 化学式: C₁₈H₁₃ClF₃N₅O
• 分子量: 407.782
• InChiKey: WAZSCWJBKICDNJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  28
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  63.4
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  7-iodo-5-chloro-6-(2,4,6-trifluorophenyl)-1,2,4-triazolo[1,5-a]pyrimidine 、 二烯丙基氨基甲酰氯 在 异丙基氯化镁 作用下， 以 四氢呋喃 为溶剂， 以35%的产率得到5-chloro-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid diallylamide
  参考文献：
  名称：

  First synthesis of 7-amido-[1,2,4]triazolo[1,5-a]pyrimidines using halogen–metal exchange

  摘要：

  A new and efficient methodology for the preparation of novel 7-carboxyl-triazolopyrimidine derivatives via the halogen-metal exchange is described. In addition, we showed that this new method can be useful for the synthesis of amides, esters, and ketones by using different carbamoyl chlorides, isocyanides or acyl chlorides as electrophile. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.04.084

文献信息

• First synthesis of 7-amido-[1,2,4]triazolo[1,5-a]pyrimidines using halogen–metal exchange
  作者：Florian Montel、Clemens Lamberth、Pierre M.J. Jung

  DOI：10.1016/j.tet.2008.04.084

  日期：2008.6

  A new and efficient methodology for the preparation of novel 7-carboxyl-triazolopyrimidine derivatives via the halogen-metal exchange is described. In addition, we showed that this new method can be useful for the synthesis of amides, esters, and ketones by using different carbamoyl chlorides, isocyanides or acyl chlorides as electrophile. (c) 2008 Elsevier Ltd. All rights reserved.