2-(2,4-Dichloro-5-fluorophenyl)-6-(4-methoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole | 1144511-87-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-(2,4-Dichloro-5-fluorophenyl)-6-(4-methoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
• CAS: 1144511-87-4
• 化学式: C₁₇H₁₀Cl₂FN₃OS
• 分子量: 394.256
• InChiKey: YBLYIUQMEGQLPL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.5
• 重原子数：
  25
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  67.7
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2-[[5-(2,4-dichloro-5-fluorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone 在 PPA 、 Polyphosphoric acid (PPA) 、 水 、 碳酸氢钠 作用下， 反应 6.0h， 以82%的产率得到2-(2,4-Dichloro-5-fluorophenyl)-6-(4-methoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
  参考文献：
  名称：

  Synthesis, analgesic, anti-inflammatory and antimicrobial studies of 2,4-dichloro-5-fluorophenyl containing thiazolotriazoles

  摘要：

  A series of 2,4-dichloro-5-fluorophenyl containing thiazolotriazoles (1) were synthesized starting from 3-(2,4-dichloro-5-fluorophenyl)-4H-1,2,4-triazole-3-thiol (5). The newly synthesized compounds were characterized by IR, H-1 NMR, mass and elemental analysis. Some of the synthesized compounds were tested for their anti-inflammatory, analgesic and antimicrobial activities. Compounds 8c, 8d and 8h exhibited excellent anti-inflammatory activity whereas compounds 8d, 8e and 8h showed excellent analgesic activity. Compounds 8a, 8c-e, and 8h exhibited good antibacterial activity and compounds 8c, 8e and 8h showed good antifungal activity. (c) 2008 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2008.04.022