(5Z)-5-((1-methyl-5-nitro-1H-imidazol-2-yl)methylene)-2-(thiazol-2-ylimino)thiazolidin-4-one | 1401514-05-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: (5Z)-5-((1-methyl-5-nitro-1H-imidazol-2-yl)methylene)-2-(thiazol-2-ylimino)thiazolidin-4-one
• 英文别名: (2E,5Z)-5-[(1-methyl-5-nitroimidazol-2-yl)methylidene]-2-(1,3-thiazol-2-ylimino)-1,3-thiazolidin-4-one
• CAS: 1401514-05-3
• 化学式: C₁₁H₈N₆O₃S₂
• 分子量: 336.355
• InChiKey: JXGBMTREKGTYPI-XQRVVYSFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  172
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  1-甲基-5-硝基-1H-咪唑-2-甲醛 、 2-(thiazol-2-ylimino)thiazolidin-4-one 在 sodium acetate 、 溶剂黄146 作用下， 反应 0.25h， 以63%的产率得到(5Z)-5-((1-methyl-5-nitro-1H-imidazol-2-yl)methylene)-2-(thiazol-2-ylimino)thiazolidin-4-one
  参考文献：
  名称：

  5-Nitro-heteroarylidene analogs of 2-thiazolylimino-4-thiazolidinones as a novel series of antibacterial agents

  摘要：

  In the pursuit of novel antibacterial agents with the 2-thiazolylimino-4-thiazolidinone as a core structure, a series of 5-nitro-heteroarylidene and 5-(2-oxoindolin-3-ylidene) analogs of 2-thiazolylimino-5-arylidene-4-thiazolidinone were synthesized and their antibacterial activities were evaluated against some strains of Gram-positive and Gram-negative bacteria, as well as Helicobacter pylori strains. Biological data indicated that 5-nitrofuran analog 5a and 5-nitroimidazole analog 7a containing no substitutions on the thiazole ring were the most potent compounds.

  DOI：

  10.1007/s00044-012-0224-6