3-(3,4,5-trimethoxyphenyl)-5-(4-bromophenyl)thiazolo<2,3-c>-s-triazole | 140423-95-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-(3,4,5-trimethoxyphenyl)-5-(4-bromophenyl)thiazolo<2,3-c>-s-triazole
• 英文别名: 5-(4-Bromophenyl)-3-(3,4,5-trimethoxyphenyl)thiazolo(2,3-c)-1,2,4-triazole；5-(4-bromophenyl)-3-(3,4,5-trimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazole
• CAS: 140423-95-6
• 化学式: C₁₉H₁₆BrN₃O₃S
• 分子量: 446.324
• InChiKey: CUIRCJFKHJXYGQ-UHFFFAOYSA-N

物化性质

• 密度：
  1.54±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  27
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  86.1
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  3,4,5-三甲氧基苯甲酰肼 在 盐酸 、 PPA 作用下， 以 乙醇 为溶剂， 反应 11.0h， 生成 3-(3,4,5-trimethoxyphenyl)-5-(4-bromophenyl)thiazolo<2,3-c>-s-triazole
  参考文献：
  名称：

  Shehata; Nasr; El-Subbagh, Scientia Pharmaceutica, 1996, vol. 64, # 2, p. 133 - 143

  摘要：

  DOI：

文献信息

• Synthesis and biological evaluation of thiazolo-triazole derivatives
  作者：R Pignatello、S Mazzone、AM Panico、G Mazzone、G Pennisi、R Castana、M Matera、G Blandino

  DOI：10.1016/0223-5234(91)90135-a

  日期：1991.12

  Two series of isomeric thiazolo[3,2-b][1,2,4]triazole and thiazolo[2,3-c][1,2,4]triazole derivatives were prepared following multiple synthetic pathways. The obtained compounds were submitted to preliminar pharmacological assays to evaluate their anti-inflammatory, analgesic and antipyretic activity. Suggestions about structure-activity relationships between the two classes of isomers were delineated. Moreover, some of the starting molecules, phenacylthio[1,2,4]triazoles were submitted to microbiological analysis to test their antibacterial and antimycotic activity.