N-(4-(4-methoxyphenyl)thiazol-2-yl)-2-(4-phenylpiperazin-1-yl)acetamide | 872057-65-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: N-(4-(4-methoxyphenyl)thiazol-2-yl)-2-(4-phenylpiperazin-1-yl)acetamide
• 英文别名: N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2-(4-phenylpiperazin-1-yl)acetamide
• CAS: 872057-65-3
• 化学式: C₂₂H₂₄N₄O₂S
• 分子量: 408.524
• InChiKey: DEZCZORCERWLNG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  85.9
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  对甲氧基苯乙酮 在 吡啶 、 溴 作用下， 以 乙醇 为溶剂， 反应 26.5h， 生成 N-(4-(4-methoxyphenyl)thiazol-2-yl)-2-(4-phenylpiperazin-1-yl)acetamide
  参考文献：
  名称：

  Design and discovery of novel thiazole derivatives as potential MMP inhibitors to protect against acute lung injury in sepsis rats via attenuation of inflammation and apoptotic oxidative stress

  摘要：

  化合物26对ICAM-1的表达和THP-1细胞粘附到活化的A549细胞的影响。

  DOI：

  10.1039/c7ra03511j

文献信息

• Synthesis and biological evaluation of new thiazolyl/benzothiazolyl-amides, derivatives of 4-phenyl-piperazine
  作者：Christina Papadopoulou、Athina Geronikaki、Dimitra Hadjipavlou-Litina

  DOI：10.1016/j.farmac.2005.06.014

  日期：2005.11

  A series of thiazolyl-N-phenyl piperazines has been synthesised and tested for anti-inflammatory activity. Their R(M) values were determined as an expression of their lipophilicity. Theoretical calculation of their lipophilicity, as clog P and logPsk also performed. The effect of the synthesised compounds on inflammation, using the carrageenin induced mouse paw oedema model was studied. In general, the studied compounds were found to be potent anti-inflammatory agents (44-74.1%). Anti-inflammatory activity was influenced by some structural characteristics of the synthesised compounds. An attempt was made to correlate their biological activity with some physicochemical parameters using a quantitative structure-activity relationship approach (QSAR).
• Design and discovery of novel thiazole derivatives as potential MMP inhibitors to protect against acute lung injury in sepsis rats via attenuation of inflammation and apoptotic oxidative stress
  作者：Lingqing Ge、Qiaozhen Hu、Mengrao Shi、Huiyun Yang、Guoji Zhu

  DOI：10.1039/c7ra03511j

  日期：——

  Effect of compound26on the expression of ICAM-1 and THP-1 cell adherence to activated A549 cells.

  化合物26对ICAM-1的表达和THP-1细胞粘附到活化的A549细胞的影响。