1,4-bis(2-benzimidazyl)-1,2,3,4-butanetetraol | 478166-45-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 1,4-bis(2-benzimidazyl)-1,2,3,4-butanetetraol
• 英文别名: 1,2,3,4-Tetrahydroxy-1,4-bis--butan；(1R,4S)-D-1,4-bis-(1H-benzoimidazol-2-yl)-erythritol；1cat_F,4cat_F-bis-(1H-benzimidazol-2-yl)-butane-1c_F,2t_F,3t_F,4r_F-tetraol；1cat_F,4cat_F-Bis-(1H-benzimidazol-2-yl)-butan-1c_F,2t_F,3t_F,4r_F-tetraol；(1R,2S,3R,4S)-1,4-bis(1H-benzimidazol-2-yl)butane-1,2,3,4-tetrol
• CAS: 478166-45-9
• 化学式: C₁₈H₁₈N₄O₄
• 分子量: 354.365
• InChiKey: UGRBLAMMQLLLQF-SYMSYNOKSA-N

物化性质

• 熔点：
  282 °C
• 沸点：
  868.1±65.0 °C(Predicted)
• 密度：
  1.613±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -0.1
• 重原子数：
  26
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  138
• 氢给体数：
  6
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 生成 1,4-bis(2-benzimidazyl)-1,2,3,4-butanetetraol
  参考文献：
  名称：

  Shdanow; Dorofeenko, Zhurnal Obshchei Khimii, 1959, vol. 29, p. 2677,2678; engl. Ausg. S. 2643, 2644

  摘要：

  DOI：

文献信息

• Synthesis and investigation of antimicrobial activity of some bisbenzimidazole-derived chelating agents
  作者：N Agh-Atabay

  DOI：10.1016/s0223-5234(03)00146-6

  日期：2003.10

  The 1,2-bis(2-benzimidazyl)-1,2-ethanediol (1), 1,4-bis(2-benzimidazyl)-1,2,3,4-butanetetraol (2), 1,3-bis(2-benzimidazyl)-2-thiapropane (3), 1,3-bis(2-benzimidazyl)-2-thia-propane-dihydrochloride (4), 1,5-bis(2-benzimidazyl)-3-thiapentane (5), and 1,5-bis(2-benzimidazyl)-3-thiapentane dihydrochloride (6) chelating ligands are synthesised and characterised by using analytical data and modem spectroscopic methods such as FT-Raman, FT-IR, H-1- and C-13-NMR spectrometers. Their antimicrobial activities are reported by comparing the in vitro activities, with those of ofloxacin, ciprofloxacin, piperacillin, ampicillin and cefazolin antibacterial agents against fresh clinical isolates. Antifungal activities are reported on Candida albicans, Candida utilis, Cryptococcus neoformans fungi, and the results are referenced with amphotericin-B, fluconazole and flucytosine antifungal agents. It has been found that all the compounds have broad spectra activity and was either more active or equipotent to those compared antibiotic and antifungal agents. (C) 2003 Editions scientifiques et medicales Elsevier SAS. All rights reserved.
• Lohmar et al., Journal of Biological Chemistry, 1942, vol. 143, p. 551,553
  作者：Lohmar et al.

  DOI：——

  日期：——