(2E)-N-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)acrylamide | 1415662-74-6

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: (2E)-N-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)acrylamide
• 英文别名: (E)-N-(4-chlorobenzo[d]thiazol-2-yl)-3-(3,4-dimethoxyphenyl)acrylamide；(E)-N-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)prop-2-enamide
• CAS: 1415662-74-6
• 化学式: C₁₈H₁₅ClN₂O₃S
• 分子量: 374.848
• InChiKey: UTHLCEPMXIICCB-VQHVLOKHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  25
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  88.7
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2-氨基-4-氯苯并噻唑 、 3,4-二甲氧基肉酸酸 在 N,N-二甲基甲酰胺 、 N,N'-二环己基碳二亚胺 作用下， 以 neat (no solvent) 为溶剂， 反应 0.05h， 以88%的产率得到(2E)-N-(4-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)acrylamide
  参考文献：
  名称：

  Synthesis of Novel Cinnamoyl Amides Using a Solvent-Free Microwave-Assisted Method

  摘要：

  A novel series of potential biologically active new cinnamoyl amides were synthesized in good yield and short reaction times. We have studied the one-pot, solvent-free reaction of cinnamic acid derivatives with aromatic amines using 1,3-dicyclohexylcarbodiimide under microwave irradiation in the presence of small quantities of dimethylformamide to improve energy transfer.

  DOI：

  10.1080/00397911.2011.604148

文献信息

• Synthesis of Novel Cinnamoyl Amides Using a Solvent-Free Microwave-Assisted Method
  作者：Rolando F. Pellón、Maite L. Docampo

  DOI：10.1080/00397911.2011.604148

  日期：2013.1.1

  A novel series of potential biologically active new cinnamoyl amides were synthesized in good yield and short reaction times. We have studied the one-pot, solvent-free reaction of cinnamic acid derivatives with aromatic amines using 1,3-dicyclohexylcarbodiimide under microwave irradiation in the presence of small quantities of dimethylformamide to improve energy transfer.