2,4,6-tris(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-1,3,5-triazine | 796889-08-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• 英文名称: 2,4,6-tris(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-1,3,5-triazine
• 英文别名: 2,4,6-tri(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-1,3,5-triazine；tptaip；2-[4,6-bis(1H-imidazo[4,5-f][1,10]phenanthrolin-2-yl)-1,3,5-triazin-2-yl]-1H-imidazo[4,5-f][1,10]phenanthroline
• CAS: 796889-08-2
• 化学式: C₄₂H₂₁N₁₅
• 分子量: 735.729
• InChiKey: DSCCWBXOHKPXJV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  57
• 可旋转键数：
  3
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  202
• 氢给体数：
  3
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  顺-双(2,2'-二吡啶基)二氯化钌(II)二水合物 、 2,4,6-tris(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-1,3,5-triazine 以 乙二醇 为溶剂， 生成 [(bpy)6Ru3(tptaip)]Cl6
  参考文献：
  名称：

  Trinuclear Ru(II) polypyridyl complexes as human telomeric quadruplex DNA stabilizers

  摘要：

  Two new trinuclear ruthenium(II) complexes [(bpy)(6)Ru-3(tpbip)](6+) (1) and [(bPY)(6)Ru-3(tptaip)](6+) (2) (bpy=2,2'-bipyridine, tpbip=1,3,5-tris(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-benzene, tptaip=2,4,6-tri(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-1,3,5-triazine) have been synthesized and characterized. The interaction of human telomeric DNA with Ru(II) complexes was explored by means of CD spectroscopy, fluorescence titration, ITC and FRET melting. Results indicated that two complexes not only induce a remarkable conformational change of human telomeric DNA, but also have the ability to stabilize the C-quadruplex. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2010.06.008
• 作为产物：
  描述：

  2,4,6-三氰基-1,3,5-三嗪 、 5,6-二氨基-1,10-邻菲罗啉 在 polyphosphoric acid 作用下， 反应 12.0h， 以48%的产率得到2,4,6-tris(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-1,3,5-triazine
  参考文献：
  名称：

  Trinuclear Ru(II) polypyridyl complexes as human telomeric quadruplex DNA stabilizers

  摘要：

  Two new trinuclear ruthenium(II) complexes [(bpy)(6)Ru-3(tpbip)](6+) (1) and [(bPY)(6)Ru-3(tptaip)](6+) (2) (bpy=2,2'-bipyridine, tpbip=1,3,5-tris(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-benzene, tptaip=2,4,6-tri(1,10-phenanthroline-[5,6-d]imidazol-2-yl)-1,3,5-triazine) have been synthesized and characterized. The interaction of human telomeric DNA with Ru(II) complexes was explored by means of CD spectroscopy, fluorescence titration, ITC and FRET melting. Results indicated that two complexes not only induce a remarkable conformational change of human telomeric DNA, but also have the ability to stabilize the C-quadruplex. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2010.06.008