bis((1-benzyl-1H-1,2,3-triazol-4-yl)methyl) succinate | 1384100-04-2

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: bis((1-benzyl-1H-1,2,3-triazol-4-yl)methyl) succinate
• 英文别名: Bis[(1-benzyltriazol-4-yl)methyl] butanedioate
• CAS: 1384100-04-2
• 化学式: C₂₄H₂₄N₆O₄
• 分子量: 460.492
• InChiKey: NKSIDSHHIJLCRC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  34
• 可旋转键数：
  13
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  114
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  二丙-2-炔基丁烷二酸酯 、 苄基叠氮 在 N,N-二异丙基乙胺 作用下， 以 乙腈 为溶剂， 生成 bis((1-benzyl-1H-1,2,3-triazol-4-yl)methyl) succinate
  参考文献：
  名称：

  Regioselective synthesis and antimicrobial studies of ester linked 1,4-disubstituted 1,2,3-bistriazoles

  摘要：

  A series of 1,4-disubstituted 1,2,3-bistriazoles was synthesized via click chemistry by cycloaddition of various bisalkynes with benzyl/2-phenylethyl azide. Synthesized triazoles were characterized by IR, H-1 NMR, C-13 NMR and mass spectral techniques. All the compounds were evaluated for antibacterial/antifungal activities and found to possess moderate to good antimicrobial activities. Further the docking study for the most active compound against DNA Gyrase was also carried out. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.05.008

文献信息

• Regioselective synthesis and antimicrobial studies of ester linked 1,4-disubstituted 1,2,3-bistriazoles
  作者：Kashmiri Lal、Ashwani Kumar、M.S. Pavan、C.P. Kaushik

  DOI：10.1016/j.bmcl.2012.05.008

  日期：2012.7

  A series of 1,4-disubstituted 1,2,3-bistriazoles was synthesized via click chemistry by cycloaddition of various bisalkynes with benzyl/2-phenylethyl azide. Synthesized triazoles were characterized by IR, H-1 NMR, C-13 NMR and mass spectral techniques. All the compounds were evaluated for antibacterial/antifungal activities and found to possess moderate to good antimicrobial activities. Further the docking study for the most active compound against DNA Gyrase was also carried out. (C) 2012 Elsevier Ltd. All rights reserved.