(2E)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]imino]-1,3-thiazolidin-4-one | 1018474-96-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: (2E)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]imino]-1,3-thiazolidin-4-one
• CAS: 1018474-96-8
• 化学式: C₁₃H₁₂N₄O₂S₂
• 分子量: 320.396
• InChiKey: IPKVKLQRPXRQOH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  130
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  硫氰酸铵 、 2-(Chloroacetamido)-5-(4-methylphenoxymethyl)-1,3,4-thiadiazole 以 N,N-二甲基甲酰胺 为溶剂， 反应 0.08h， 以92%的产率得到(2E)-2-[[5-[(4-methylphenoxy)methyl]-1,3,4-thiadiazol-2-yl]imino]-1,3-thiazolidin-4-one
  参考文献：
  名称：

  Synthesis of 2‐(5‐Substituted‐1,3,4‐thiadiazolo‐2‐ylimino)‐4‐thiazolidinones under Microwave Irradiation

  摘要：

  Fifteen 2-(5-substituted-1,3,4-thiadiazolo-2-ylimino)-4-thiazolidinones were efficiently synthesized from the reaction of ammonium thiocyanate with 2-chloro-N-(5-substutited-1,3,4-thiadiazolo-2-yl)acetamides under microwave irradiation. The target compounds were obtained in better yields (75-98%) and shorter time (5min) than with conventional heating.

  DOI：

  10.1080/00397910701845852

文献信息

• Synthesis of 2‐(5‐Substituted‐1,3,4‐thiadiazolo‐2‐ylimino)‐4‐thiazolidinones under Microwave Irradiation
  作者：Xi-Cun Wang、Guo-Li Huang、Zheng-Jun Quan、Cheng-Wei Lv、Wen-Long Yang

  DOI：10.1080/00397910701845852

  日期：2008.2.1

  Fifteen 2-(5-substituted-1,3,4-thiadiazolo-2-ylimino)-4-thiazolidinones were efficiently synthesized from the reaction of ammonium thiocyanate with 2-chloro-N-(5-substutited-1,3,4-thiadiazolo-2-yl)acetamides under microwave irradiation. The target compounds were obtained in better yields (75-98%) and shorter time (5min) than with conventional heating.