1,4-bis-(1H-imidazol-1-yl)butane dihydrochloride

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1,4-bis-(1H-imidazol-1-yl)butane dihydrochloride
• 英文别名: 1-(4-Imidazol-1-ylbutyl)imidazole;hydrochloride
• 化学式: C₁₀H₁₄N₄*2ClH
• 分子量: 263.17
• InChiKey: HPKAFDNGTWMUGV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.98
• 重原子数：
  15
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  35.6
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1,4-bis-(1H-imidazol-1-yl)butane dihydrochloride 在 ammonium hexafluorophosphate 作用下， 以 水 为溶剂， 以88%的产率得到
  参考文献：
  名称：

  Self-assembly of [2]pseudorotaxanes based on pillar[5]arene and bis(imidazolium) cations

  摘要：

  一种简单的双（咪唑鎓）二阳离子，1,4-双[N-（N′-氢咪唑鎓）]丁烷，可以作为与柱[5]芳烃形成[2]伪滑轮的新模板，其中穿脱和重新穿过程可以通过添加碱和酸进行控制。还描述了溶剂和对离子对结合常数的影响。

  DOI：

  10.1039/c0cc03575k
• 作为产物：
  描述：

  双咪唑丁烷 在 盐酸 作用下， 以 甲醇 、 水 为溶剂， 以95%的产率得到1,4-bis-(1H-imidazol-1-yl)butane dihydrochloride
  参考文献：
  名称：

  Self-assembly of [2]pseudorotaxanes based on pillar[5]arene and bis(imidazolium) cations

  摘要：

  一种简单的双（咪唑鎓）二阳离子，1,4-双[N-（N′-氢咪唑鎓）]丁烷，可以作为与柱[5]芳烃形成[2]伪滑轮的新模板，其中穿脱和重新穿过程可以通过添加碱和酸进行控制。还描述了溶剂和对离子对结合常数的影响。

  DOI：

  10.1039/c0cc03575k

文献信息

• TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF
  申请人：Crandall Ian E.

  公开号：US20110257235A1

  公开（公告）日：2011-10-20

  The present disclosure relates to certain new and known triazolium and/or imidazolium salts and to their therapeutic use, for example in methods of treating or preventing an infection by a Plasmodium or Babesia parasite in a subject in need thereof. The triazolium and imidazolium salts are compounds of the Formula (I) or (II): wherein R 1 -R 4 , R 1′ -R 3′ , R 8 -R 11 , X, X′, X″, Y, Y′ and Y″ are as defined in the disclosure.

  本公开涉及某些新的和已知的三唑和/或咪唑盐及其治疗用途，例如在治疗或预防受需要的主体中由Plasmodium或Babesia寄生虫引起的感染的方法中。三唑和咪唑盐是以下化合物的化合物：其中R1-R4，R1′-R3′，R8-R11，X，X′，X″，Y，Y′和Y″如本公开所定义。
• The anti-malarial activity of bivalent imidazolium salts
  作者：Jason Z. Vlahakis、Simona Mitu、Gheorghe Roman、E. Patricia Rodriguez、Ian E. Crandall、Walter A. Szarek

  DOI：10.1016/j.bmc.2011.06.002

  日期：2011.11

  A series of compounds containing bivalent imidazolium rings and one triazolium analog were synthesized and evaluated for their ability to inhibit the replication of Plasmodium falciparum cultures. The activity and selectivity of the compounds for P. falciparum cultures were found to depend on the presence of electron-deficient rings that were spaced an appropriate distance apart. The activity of the compounds was not critically dependent on the nature of the linker between the electron-deficient rings, an observation that suggests that the rings were responsible for the primary interaction with the molecular target of the compounds in the parasite. The bivalent imidazolium and triazolium compounds disrupted the process whereby merozoites gain entry into erythrocytes, however, they did not appear to prevent merozoites from forming. The compounds were also found to be active in a murine Plasmodium berghei infection, a result consistent with the compounds specifically interacting with a parasite component that is required for replication and is conserved between two Plasmodium species. (C) 2011 Elsevier Ltd. All rights reserved.
• Self-assembly of [2]pseudorotaxanes based on pillar[5]arene and bis(imidazolium) cations
  作者：Chunju Li、Liu Zhao、Jian Li、Xia Ding、Songhui Chen、Qiaolin Zhang、Yihua Yu、Xueshun Jia

  DOI：10.1039/c0cc03575k

  日期：——

  A simple bis(imidazolium) dication, 1,4-bis[N-(N′-hydroimidazolium)]butane, can act as a new template for formation of [2]pseudorotaxane with pillar[5]arene, in which the dethreading/rethreading process can be controlled by addition of base and acid. The effect on the association constant of both the solvent and counterion is also described.

  一种简单的双（咪唑鎓）二阳离子，1,4-双[N-（N′-氢咪唑鎓）]丁烷，可以作为与柱[5]芳烃形成[2]伪滑轮的新模板，其中穿脱和重新穿过程可以通过添加碱和酸进行控制。还描述了溶剂和对离子对结合常数的影响。