N,N'-bis(6A-deoxy-γ-cyclodextrin-6A-yl)succinamide | 1225443-75-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: N,N'-bis(6A-deoxy-γ-cyclodextrin-6A-yl)succinamide
• 英文别名: N,N'-bis[[(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36S,38R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R,50R,51R,52R,53R,54R,55R,56R)-41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecahydroxy-10,15,20,25,30,35,40-heptakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontan-5-yl]methyl]butanediamide
• CAS: 1225443-75-3
• 化学式: C₁₀₀H₁₆₄N₂O₈₀
• 分子量: 2674.37
• InChiKey: MBKQREZZJJTACG-PLWGICDQSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -34.7
• 重原子数：
  182
• 可旋转键数：
  21
• 环数：
  60.0
• sp3杂化的碳原子比例：
  0.98
• 拓扑面积：
  1280
• 氢给体数：
  48
• 氢受体数：
  80

反应信息

• 作为产物：
  描述：

  bis(p-nitrophenyl) succinate 、 mono-6-deoxy-6-amino-γ-cyclodextrin 在 吡啶 作用下， 反应 49.0h， 以91.6%的产率得到N,N'-bis(6A-deoxy-γ-cyclodextrin-6A-yl)succinamide
  参考文献：
  名称：

  Synthesis of C6A-to-C6A and C3A-to-C3A diamide linked γ-cyclodextrin dimers

  摘要：

  The syntheses of three new diamide-linked gamma-cyclodextrin dimers joined by substitution at either a glucopyranose C6(A) or C3(A) carbon are reported. The syntheses involve the reaction of either C6(A) or C3(A) amino-substituted gamma-cyclodextrin with bis(4-nitrophenyl)succinate to form succinamide linked gamma-cyclodextrin dimers or reaction of C6(A) aside-substituted gamma-cyclodextrin with carbon dioxide to form a urea linked gamma-cyclodextrin dimer. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2010.02.005

文献信息

• Synthesis of C6A-to-C6A and C3A-to-C3A diamide linked γ-cyclodextrin dimers
  作者：Duc-Truc Pham、Huy Tien Ngo、Stephen F. Lincoln、Bruce L. May、Christopher J. Easton

  DOI：10.1016/j.tet.2010.02.005

  日期：2010.4

  The syntheses of three new diamide-linked gamma-cyclodextrin dimers joined by substitution at either a glucopyranose C6(A) or C3(A) carbon are reported. The syntheses involve the reaction of either C6(A) or C3(A) amino-substituted gamma-cyclodextrin with bis(4-nitrophenyl)succinate to form succinamide linked gamma-cyclodextrin dimers or reaction of C6(A) aside-substituted gamma-cyclodextrin with carbon dioxide to form a urea linked gamma-cyclodextrin dimer. (C) 2010 Elsevier Ltd. All rights reserved.