2-Imino-3-(5-nonyl-[1,3,4]thiadiazol-2-yl)-thiazolidin-4-one | 672306-65-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-Imino-3-(5-nonyl-[1,3,4]thiadiazol-2-yl)-thiazolidin-4-one
• 英文别名: 2-Imino-3-(5-nonyl-1,3,4-thiadiazol-2-YL)-1,3-thiazolidin-4-one；2-imino-3-(5-nonyl-1,3,4-thiadiazol-2-yl)-1,3-thiazolidin-4-one
• CAS: 672306-65-9
• 化学式: C₁₄H₂₂N₄OS₂
• 分子量: 326.487
• InChiKey: NZWQBAZXHZPJFN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  21
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  124
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  氯乙酸 、 (5-Nonyl-[1,3,4]thiadiazol-2-yl)-thiourea 在 aluminum oxide 作用下， 反应 0.09h， 以85%的产率得到2-(5-Nonyl-[1,3,4]thiadiazol-2-ylamino)-thiazol-4-one
  参考文献：
  名称：

  摘要：

  Novel 2-(5-R-1,3,4-thiadiazol-2-yl)aminothiazolin-4-ones 6a-h and 2-imino-3-(5-R-1,3,4-thiadiazol-2-yl)thiazolidin-4-ones 7a-h were prepared by treating N-(5-R-1,3,4-thiadiazol-2-yl)thioureas 4a-h with chloroacetic acid on various solid supports under microwave irradiation. Tautomeric mixtures of compounds 6a-h and 7a-h were obtained in all cases. In alkaline and neutral media, compounds 6a-h were the major products, while ill acid media, 7a-h were the major products.

  DOI：

  10.1023/a:1025649227322

文献信息

• ——
  作者：M. Kidwai、A. D. Mishra

  DOI：10.1023/a:1025649227322

  日期：——

  Novel 2-(5-R-1,3,4-thiadiazol-2-yl)aminothiazolin-4-ones 6a-h and 2-imino-3-(5-R-1,3,4-thiadiazol-2-yl)thiazolidin-4-ones 7a-h were prepared by treating N-(5-R-1,3,4-thiadiazol-2-yl)thioureas 4a-h with chloroacetic acid on various solid supports under microwave irradiation. Tautomeric mixtures of compounds 6a-h and 7a-h were obtained in all cases. In alkaline and neutral media, compounds 6a-h were the major products, while ill acid media, 7a-h were the major products.