2,9,17,24,27,29,37,39-Octazaheptacyclo[35.3.1.125,29.03,8.09,40.017,26.018,23]dotetraconta-1,3,5,7,18,20,22,24,26,39-decaene-28,38,41,42-tetrone | 1022948-21-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 蝶啶及其衍生物
• 英文名称: 2,9,17,24,27,29,37,39-Octazaheptacyclo[35.3.1.125,29.03,8.09,40.017,26.018,23]dotetraconta-1,3,5,7,18,20,22,24,26,39-decaene-28,38,41,42-tetrone
• 英文别名: 2,9,17,24,27,29,37,39-octazaheptacyclo[35.3.1.125,29.03,8.09,40.017,26.018,23]dotetraconta-1,3,5,7,18,20,22,24,26,39-decaene-28,38,41,42-tetrone
• CAS: 1022948-21-5
• 化学式: C₃₄H₃₆N₈O₄
• 分子量: 620.711
• InChiKey: LMWCRVKNADNDQP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  46
• 可旋转键数：
  0
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  131
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  10,10'-(heptane-1,7-diyl)bis(benzo[g]pteridine-2,4(3H,10H)-dione) 、 1,7-二碘庚烷 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 2,9,17,24,27,29,37,39-Octazaheptacyclo[35.3.1.125,29.03,8.09,40.017,26.018,23]dotetraconta-1,3,5,7,18,20,22,24,26,39-decaene-28,38,41,42-tetrone
  参考文献：
  名称：

  Synthesis and electrochemical behavior of clothespin-shaped bisflavin compounds

  摘要：

  Clothespin-shaped bisflavin compounds 1 bearing doubly linked 3,3':10,10'-methylene spacers exhibited significant enhancement of specific association with a variety of neutral aromatic compounds in DMF under electroreduction conditions. This specificity could be rationalized by the 'electric clip motion' of intermediate bis-anion radical species. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.02.122

文献信息

• Synthesis and electrochemical behavior of clothespin-shaped bisflavin compounds
  作者：Yasushi Imada、Takashi Ohno、Takeshi Naota

  DOI：10.1016/j.tetlet.2008.02.122

  日期：2008.4

  Clothespin-shaped bisflavin compounds 1 bearing doubly linked 3,3':10,10'-methylene spacers exhibited significant enhancement of specific association with a variety of neutral aromatic compounds in DMF under electroreduction conditions. This specificity could be rationalized by the 'electric clip motion' of intermediate bis-anion radical species. (c) 2008 Elsevier Ltd. All rights reserved.