N-(3-(pyren-2-yl)-imidazo[1,5-a]pyridin-1-yl)picolinamidine | 1374243-79-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: N-(3-(pyren-2-yl)-imidazo[1,5-a]pyridin-1-yl)picolinamidine
• 英文别名: N'-(3-pyren-2-ylimidazo[1,5-a]pyridin-1-yl)pyridine-2-carboximidamide
• CAS: 1374243-79-4
• 化学式: C₂₉H₁₉N₅
• 分子量: 437.503
• InChiKey: ABNMUYRYPHDRPD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.9
• 重原子数：
  34
• 可旋转键数：
  3
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  68.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-氰基吡啶 、 2-pyrenecarboxaldehyde 在 ammonium acetate 作用下， 反应 12.0h， 以82%的产率得到N-(3-(pyren-2-yl)-imidazo[1,5-a]pyridin-1-yl)picolinamidine
  参考文献：
  名称：

  Synthesis of 3-substituted imidazo[1,5-a]pyridines having 1-(N-picolinamidin-2-yl) group

  摘要：

  The 3-substituted imidazo[1,5-a]pyridine compounds having 1-(N-picolinamidin-2-yl) group (1a-h) were synthesized by heating 1 equiv of an aldehyde (eight examples), 2 equiv of 2-cyanopyridine and ammonium acetate in PEG-400. By heating 2 equiv of the aldehyde and 1 equiv of 2-cyanopyridine under the same experimental conditions, 2,4,5-trisubstituted imidazoles (2a-c) were isolated. All the reported compounds were thoroughly characterized and the molecular structures of la and 2b were established by single crystal X-ray diffraction studies. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2012.03.095

文献信息

• Synthesis of 3-substituted imidazo[1,5-a]pyridines having 1-(N-picolinamidin-2-yl) group
  作者：Vijendra Kumar Fulwa、Vadivelu Manivannan

  DOI：10.1016/j.tet.2012.03.095

  日期：2012.5

  The 3-substituted imidazo[1,5-a]pyridine compounds having 1-(N-picolinamidin-2-yl) group (1a-h) were synthesized by heating 1 equiv of an aldehyde (eight examples), 2 equiv of 2-cyanopyridine and ammonium acetate in PEG-400. By heating 2 equiv of the aldehyde and 1 equiv of 2-cyanopyridine under the same experimental conditions, 2,4,5-trisubstituted imidazoles (2a-c) were isolated. All the reported compounds were thoroughly characterized and the molecular structures of la and 2b were established by single crystal X-ray diffraction studies. (C) 2012 Elsevier Ltd. All rights reserved.