tert-butyl N-[2-[4-[3-[[5,11,17,23-tetratert-butyl-27-hydroxy-26,28-bis[[6-(6-methylpyridin-2-yl)pyridin-2-yl]methoxy]-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]oxy]propoxy]phenyl]ethyl]carbamate | 1192881-05-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: tert-butyl N-[2-[4-[3-[[5,11,17,23-tetratert-butyl-27-hydroxy-26,28-bis[[6-(6-methylpyridin-2-yl)pyridin-2-yl]methoxy]-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]oxy]propoxy]phenyl]ethyl]carbamate
• CAS: 1192881-05-2
• 化学式: C₈₄H₉₉N₅O₇
• 分子量: 1290.74
• InChiKey: ZFZBRQMZINSEQY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  19.9
• 重原子数：
  96
• 可旋转键数：
  23
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  147
• 氢给体数：
  2
• 氢受体数：
  11

反应信息

• 作为反应物：
  描述：

  tert-butyl N-[2-[4-[3-[[5,11,17,23-tetratert-butyl-27-hydroxy-26,28-bis[[6-(6-methylpyridin-2-yl)pyridin-2-yl]methoxy]-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]oxy]propoxy]phenyl]ethyl]carbamate 、 三氟乙酸 以 二氯甲烷 为溶剂， 反应 4.0h， 以64%的产率得到
  参考文献：
  名称：

  Cu(I) and Zn(II) chelations on polymer beads modified by attachment of a bipyridyl-calixarene-based chelate

  摘要：

  A new chelating calix[4]arene derivative incorporating two bipyridyl groups and one primary amino attachment function at the lower rim has been synthesised and coupled to Wang benzaldehyde resin. The new material effectively displayed complexation abilities towards Cu(I) and Zn(II) transition metal cations. The grafting efficiency was evaluated and quantified by complexation experiments, using UV/visible spectrophotometry, and ionic chromatography. (C) 2009 Published by Elsevier Ltd.

  DOI：

  10.1016/j.tetlet.2009.07.131
• 作为产物：
  描述：

  p-(bromopropyl)-(N-Boc)-tyramine 、 5,11,17,23-tetra(tert-butyl)-26,28-bis<(6-methyl-2,2'-bipyridyl-6'-yl)methoxy>calix<4>arene-25,27-diol 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 24.25h， 以87%的产率得到tert-butyl N-[2-[4-[3-[[5,11,17,23-tetratert-butyl-27-hydroxy-26,28-bis[[6-(6-methylpyridin-2-yl)pyridin-2-yl]methoxy]-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]oxy]propoxy]phenyl]ethyl]carbamate
  参考文献：
  名称：

  Cu(I) and Zn(II) chelations on polymer beads modified by attachment of a bipyridyl-calixarene-based chelate

  摘要：

  A new chelating calix[4]arene derivative incorporating two bipyridyl groups and one primary amino attachment function at the lower rim has been synthesised and coupled to Wang benzaldehyde resin. The new material effectively displayed complexation abilities towards Cu(I) and Zn(II) transition metal cations. The grafting efficiency was evaluated and quantified by complexation experiments, using UV/visible spectrophotometry, and ionic chromatography. (C) 2009 Published by Elsevier Ltd.

  DOI：

  10.1016/j.tetlet.2009.07.131

文献信息

• Cu(I) and Zn(II) chelations on polymer beads modified by attachment of a bipyridyl-calixarene-based chelate
  作者：Yannick de Gaetano、Igor Clarot、Jean-Bernard Regnouf-de-Vains

  DOI：10.1016/j.tetlet.2009.07.131

  日期：2009.10

  A new chelating calix[4]arene derivative incorporating two bipyridyl groups and one primary amino attachment function at the lower rim has been synthesised and coupled to Wang benzaldehyde resin. The new material effectively displayed complexation abilities towards Cu(I) and Zn(II) transition metal cations. The grafting efficiency was evaluated and quantified by complexation experiments, using UV/visible spectrophotometry, and ionic chromatography. (C) 2009 Published by Elsevier Ltd.