N-(6-amino-1,10-phenanthrolin-5-yl)-4-nitrobenzenesulfonamide 4-nitrobenzenesulfonate | 1262040-08-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: N-(6-amino-1,10-phenanthrolin-5-yl)-4-nitrobenzenesulfonamide 4-nitrobenzenesulfonate
• CAS: 1262040-08-3
• 化学式: C₆H₅NO₅S*C₁₈H₁₃N₅O₄S
• 分子量: 598.574
• InChiKey: OFEWQLUURUKHTM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.92
• 重原子数：
  41.0
• 可旋转键数：
  6.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  238.62
• 氢给体数：
  3.0
• 氢受体数：
  11.0

反应信息

• 作为反应物：
  描述：

  ammonium hexafluorophosphate 、 水 、 顺-双(2,2-二吡啶)二氯化钌(II) 水合物 、 N-(6-amino-1,10-phenanthrolin-5-yl)-4-nitrobenzenesulfonamide 4-nitrobenzenesulfonate 以 乙醇 、 水 为溶剂， 以60%的产率得到
  参考文献：
  名称：

  Synthesis and anion-sensing property of a family of Ru(II)-based receptors containing functionalized polypyridine as binding site

  摘要：

  A family of fluoroionophores have been synthesized incorporating Ru(II)-bipyridine moiety as fluorogenic unit and amino/benzenesulphonamido functionalized 1,10-phenanthroline moiety, attached to Ru(II), as binding sites. Two of the ligands and one of the complexes have been characterized crystallographically. Anion recognition property, studied by luminescence, UV-vis and H-1 NMR spectroscopy, with a large number of anions exhibit strong complexation with F-, H2PO4- and AcO-. Binding constants have been determined from luminescence titration and H-1 NMR study gave insight about binding site of anions. Bidentate chelating nature of the H2PO4- and AcO- anions and steric crowding created by benzenesulphonamide moiety has significantly influenced binding constants and selectivity. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2010.09.002
• 作为产物：
  描述：

  5,6-二氨基-1,10-邻菲罗啉 、 对硝基苯磺酰氯 在 吡啶 作用下， 生成 N-(6-amino-1,10-phenanthrolin-5-yl)-4-nitrobenzenesulfonamide 4-nitrobenzenesulfonate
  参考文献：
  名称：

  Synthesis and anion-sensing property of a family of Ru(II)-based receptors containing functionalized polypyridine as binding site

  摘要：

  A family of fluoroionophores have been synthesized incorporating Ru(II)-bipyridine moiety as fluorogenic unit and amino/benzenesulphonamido functionalized 1,10-phenanthroline moiety, attached to Ru(II), as binding sites. Two of the ligands and one of the complexes have been characterized crystallographically. Anion recognition property, studied by luminescence, UV-vis and H-1 NMR spectroscopy, with a large number of anions exhibit strong complexation with F-, H2PO4- and AcO-. Binding constants have been determined from luminescence titration and H-1 NMR study gave insight about binding site of anions. Bidentate chelating nature of the H2PO4- and AcO- anions and steric crowding created by benzenesulphonamide moiety has significantly influenced binding constants and selectivity. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2010.09.002