4,4'-pentanediyldioxy-di-aniline; dihydrochloride | 1092-82-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 4,4'-pentanediyldioxy-di-aniline; dihydrochloride
• 英文别名: 4,4'-Pentandiyldioxy-di-anilin; Dihydrochlorid；4,4'-(Pentamethylenedioxy)dianiline hydrochloride；4-[5-(4-aminophenoxy)pentoxy]aniline;hydrochloride
• CAS: 1092-82-6
• 化学式: C₁₇H₂₂N₂O₂*2ClH
• 分子量: 359.296
• InChiKey: JGAHDDMIYDDHBN-UHFFFAOYSA-N

物化性质

• 熔点：
  256-260 °C (decomp)

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  22
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  70.5
• 氢给体数：
  3
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4,4'-pentanediyldioxy-di-aniline; dihydrochloride 在 碳酸氢钠 作用下， 以 水 为溶剂， 反应 1.0h， 生成 4,4'-(1,5-戊二氧基)二苯胺
  参考文献：
  名称：

  Griffin; Britt; Hung, Molecular Crystals and Liquid Crystals (1969-1991), 1983, vol. 105, # 1-4, p. 305 - 314

  摘要：

  DOI：
• 作为产物：
  描述：

  对乙酰氨基酚 在 盐酸 、 potassium carbonate 作用下， 以 乙醇 、 N,N-二甲基甲酰胺 为溶剂， 反应 4.0h， 生成 4,4'-pentanediyldioxy-di-aniline; dihydrochloride
  参考文献：
  名称：

  Griffin; Britt; Hung, Molecular Crystals and Liquid Crystals (1969-1991), 1983, vol. 105, # 1-4, p. 305 - 314

  摘要：

  DOI：

文献信息

• Novel bis[1,6-dihydro-6,6-dimethyl-1,3,5-triazine-2,4-diamines] as antitrypanosomal agents
  作者：William R. Turner、Leslie M. Werbel

  DOI：10.1021/jm00149a032

  日期：1985.11

  A series of novel 1,1'-(4,1-phenylene)bis [1,6-dihydro-6,6-dimethyl-1,3,5-triazine-2,4-diamines] was prepared and evaluated for activity against Trypanosoma rhodesiense in mice. The importance of the bis structure and the nature of the spacer between the two phenyl rings for optimal activity have been revealed. The potent parenteral activity of several analogues within this series as well as preliminary indication of oral activity lends encouragement to further development of this structural class.
• Biological properties of amidinium sulfinic and sulfonic acid derivatives: inhibition of glycolytic enzymes of Trypanosoma brucei and protective effect on cell growth
  作者：M Willson、JJ Périé、F Malecaze、F Opperdoes、M Callens

  DOI：10.1016/0223-5234(92)90114-g

  日期：1992.11

  The activity of the title compounds has been investigated on two biological targets: cultures of trypanosome and glycolytic enzymes inhibition of the parasite, and on retinal epithelium cells. In both cases, these compounds exhibit a significant activity, in some cases more selective than this for the drug suramin, with a lower toxicity. The effect of these compounds, which exist as neutral and zwitterionic forms in the case of sulfinic, only as zwitterionic in the case of sulfonic derivatives can be understood via their action on clusters of positive charges which are present at the surface of the proteins involved in the processes: glycolytic enzymes of the trypanosome in the first part, basic fibroblast growth factor in the second.
• Griffin; Britt; Hung, Molecular Crystals and Liquid Crystals (1969-1991), 1983, vol. 105, # 1-4, p. 305 - 314
  作者：Griffin、Britt、Hung、Steele

  DOI：——

  日期：——