4-(2-{[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio}ethoxy)benzaldehyde | 1383783-64-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 4-(2-{[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio}ethoxy)benzaldehyde
• 英文别名: 4-[2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzaldehyde
• CAS: 1383783-64-9
• 化学式: C₁₇H₁₄ClN₃O₂S
• 分子量: 359.836
• InChiKey: JGMKBQPETWMSIT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.11
• 重原子数：
  24.0
• 可旋转键数：
  7.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  67.87
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  2,4-噻唑烷二酮 、 4-(2-{[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio}ethoxy)benzaldehyde 在 哌啶乙酸盐 作用下， 以 甲苯 为溶剂， 以89%的产率得到(Z)-5-[4-(2-{[5-(4-chloro-phenyl)-4H-1,2,4-triazol-3-yl]thio}ethoxy)benzylidene]-1,3-thiazolidine-2,4-dione
  参考文献：
  名称：

  Synthesis, hypoglycemic and hypolipidemic activities of novel thiazolidinedione derivatives containing thiazole/triazole/oxadiazole ring

  摘要：

  Novel thiazolidinedione derivatives were synthesized by incorporating pharmacologically significant heterocycles viz, substituted thiazole, triazole, and oxadiazole moieties linked to the central phenyl ring via heteroatomlinkage with one/two carbon spacer as the structural analogs of Pioglitazone by employing multistep synthetic protocols. Structures of all the newly synthesized intermediates and target molecules were established by analytical and spectral data. These newly synthesized compounds were screened for their invivo hypoglycemic and hypolipidemic activities in male wistar rats. Some of the synthesized compounds demonstrated good activity. (C) 2012 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2012.04.015
• 作为产物：
  描述：

  对羟基苯甲醛 在 potassium carbonate 、 potassium hydroxide 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 4.33h， 生成 4-(2-{[5-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]thio}ethoxy)benzaldehyde
  参考文献：
  名称：

  Synthesis, hypoglycemic and hypolipidemic activities of novel thiazolidinedione derivatives containing thiazole/triazole/oxadiazole ring

  摘要：

  Novel thiazolidinedione derivatives were synthesized by incorporating pharmacologically significant heterocycles viz, substituted thiazole, triazole, and oxadiazole moieties linked to the central phenyl ring via heteroatomlinkage with one/two carbon spacer as the structural analogs of Pioglitazone by employing multistep synthetic protocols. Structures of all the newly synthesized intermediates and target molecules were established by analytical and spectral data. These newly synthesized compounds were screened for their invivo hypoglycemic and hypolipidemic activities in male wistar rats. Some of the synthesized compounds demonstrated good activity. (C) 2012 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2012.04.015