5-(6-Azido-1,3-benzodioxol-5-yl)-4-phenyl-1-(3-phenylprop-2-ynyl)imidazole | 873890-40-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 5-(6-Azido-1,3-benzodioxol-5-yl)-4-phenyl-1-(3-phenylprop-2-ynyl)imidazole
• 英文别名: 5-(6-azido-1,3-benzodioxol-5-yl)-4-phenyl-1-(3-phenylprop-2-ynyl)imidazole
• CAS: 873890-40-5
• 化学式: C₂₅H₁₇N₅O₂
• 分子量: 419.442
• InChiKey: MIAWNTYPIJGUDA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.1
• 重原子数：
  32
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  50.6
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  5-(6-Azido-1,3-benzodioxol-5-yl)-4-phenyl-1-(3-phenylprop-2-ynyl)imidazole 在 copper(II) sulfate sodium ascorbate 作用下， 以 水 、 叔丁醇 为溶剂， 以62%的产率得到5,11-Diphenyl-16,18-dioxa-2,3,4,8,10-pentazapentacyclo[11.7.0.02,6.08,12.015,19]icosa-1(20),3,5,9,11,13,15(19)-heptaene
  参考文献：
  名称：

  Synthesis of fused triazolo-imidazole derivatives by sequential van Leusen/alkyne–azide cycloaddition reactions

  摘要：

  A facile synthesis of fused triazolo imidazole derivatives by a van Leusen/alkyne-azide cycloaddition synthetic sequence is reported. The two-step reaction sequence generates compounds of significant molecular complexity from simple starting materials in an expedient fashion with good overall yields. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.10.090
• 作为产物：
  描述：

  2-(3-phenylprop-2-yn-1-yl)isoindoline-1,3-dione 在 肼 作用下， 以 甲醇 、 N,N-二甲基甲酰胺 为溶剂， 生成 5-(6-Azido-1,3-benzodioxol-5-yl)-4-phenyl-1-(3-phenylprop-2-ynyl)imidazole
  参考文献：
  名称：

  Synthesis of fused triazolo-imidazole derivatives by sequential van Leusen/alkyne–azide cycloaddition reactions

  摘要：

  A facile synthesis of fused triazolo imidazole derivatives by a van Leusen/alkyne-azide cycloaddition synthetic sequence is reported. The two-step reaction sequence generates compounds of significant molecular complexity from simple starting materials in an expedient fashion with good overall yields. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.10.090

文献信息

• Synthesis of fused triazolo-imidazole derivatives by sequential van Leusen/alkyne–azide cycloaddition reactions
  作者：Vijaya Gracias、Daria Darczak、Alan F. Gasiecki、Stevan W. Djuric

  DOI：10.1016/j.tetlet.2005.10.090

  日期：2005.12

  A facile synthesis of fused triazolo imidazole derivatives by a van Leusen/alkyne-azide cycloaddition synthetic sequence is reported. The two-step reaction sequence generates compounds of significant molecular complexity from simple starting materials in an expedient fashion with good overall yields. (c) 2005 Elsevier Ltd. All rights reserved.