(5Z)-2-(4-(4-methoxyphenyl)thiazol-2-ylimino)-5-((5-nitrothiophen-2-yl)methylene)thiazolidin-4-one | 1401514-03-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 噻吩类
• 英文名称: (5Z)-2-(4-(4-methoxyphenyl)thiazol-2-ylimino)-5-((5-nitrothiophen-2-yl)methylene)thiazolidin-4-one
• 英文别名: (2E,5Z)-2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]imino]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-thiazolidin-4-one
• CAS: 1401514-03-1
• 化学式: C₁₈H₁₂N₄O₄S₃
• 分子量: 444.516
• InChiKey: LRAPNYWUPZZJLZ-ZSOIEALJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  29
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  191
• 氢给体数：
  1
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  2-氯-N-[4-(4-甲氧基苯基)-噻唑-2-基]-乙酰胺 在 sodium acetate 、 溶剂黄146 作用下， 以 乙醇 为溶剂， 反应 2.25h， 生成 (5Z)-2-(4-(4-methoxyphenyl)thiazol-2-ylimino)-5-((5-nitrothiophen-2-yl)methylene)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

文献信息

• 5-Nitro-heteroarylidene analogs of 2-thiazolylimino-4-thiazolidinones as a novel series of antibacterial agents
  作者：Nouraddin Hosseinzadeh、Mohammad Hasani、Alireza Foroumadi、Hamid Nadri、Saeed Emami、Nasrin Samadi、Mohammad Ali Faramarzi、Parastoo Saniee、Farideh Siavoshi、Neda Abadian、Yasaman Mahmoudjanlou、Amirhossein Sakhteman、Alireza Moradi、Abbas Shafiee

  DOI：10.1007/s00044-012-0224-6

  日期：2013.5

  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.