| 1204670-74-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 1204670-74-5
• 化学式: C₃₈H₄₆F₃N₃O₅
• 分子量: 681.796
• InChiKey: OEOTWNKXSUWFGO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.47
• 重原子数：
  49.0
• 可旋转键数：
  20.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  115.81
• 氢给体数：
  3.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  在 草酰氯 、 N,N-二甲基甲酰胺 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  Self-assembly of vesicles from the stacking of a dipodal F⋯H–N hydrogen bonded arylamide foldamer

  摘要：

  In this paper, we report the synthesis and self-assembling behavior of an F center dot center dot center dot H-N hydrogen bonding-induced arylamide-based dipodal foldamer. SEM, AFM. TEM, and XRD studies reveal that this preorganized oligomer stacks to form vesicles in methanol-chloroform (10-70%) binary solvents due to the strong stacking interaction of the folded segments and the supramolecular polymeric feature of the dipodal molecule in the stacked state. In contrast, a simple folded molecule can give rise to vesicles only when the chloroform content is 45-55%. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.10.073
• 作为产物：
  描述：

  methyl 3-((5-(dioctylcarbamoyl)-2-fluoro-3-(2-fluorobenzamido)phenyl)carbamoyl)-2-fluorobenzoate 在 potassium hydroxide 、 盐酸 作用下， 以 四氢呋喃 、 水 为溶剂， 反应 4.5h， 以95%的产率得到
  参考文献：
  名称：

  Self-assembly of vesicles from the stacking of a dipodal F⋯H–N hydrogen bonded arylamide foldamer

  摘要：

  In this paper, we report the synthesis and self-assembling behavior of an F center dot center dot center dot H-N hydrogen bonding-induced arylamide-based dipodal foldamer. SEM, AFM. TEM, and XRD studies reveal that this preorganized oligomer stacks to form vesicles in methanol-chloroform (10-70%) binary solvents due to the strong stacking interaction of the folded segments and the supramolecular polymeric feature of the dipodal molecule in the stacked state. In contrast, a simple folded molecule can give rise to vesicles only when the chloroform content is 45-55%. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.10.073