N-[4-[6-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxyhexoxy]phenyl]-2-[[5,11,17,23-tetratert-butyl-26,28-dihydroxy-27-[2-oxo-2-[4-[6-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxyhexoxy]anilino]ethoxy]-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]acetamide | 1365449-18-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: N-[4-[6-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxyhexoxy]phenyl]-2-[[5,11,17,23-tetratert-butyl-26,28-dihydroxy-27-[2-oxo-2-[4-[6-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxyhexoxy]anilino]ethoxy]-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]acetamide
• CAS: 1365449-18-8
• 化学式: C₁₅₈H₂₁₄N₂O₂₀
• 分子量: 2461.44
• InChiKey: JEGKLMSFBMMZRR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  45.1
• 重原子数：
  180
• 可旋转键数：
  80
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  246
• 氢给体数：
  4
• 氢受体数：
  20

反应信息

• 作为产物：
  描述：

  5,11,17,23-tetra-t-butyl-25,26,27,28-tetrahydroxycalix-4-arene 、 在 potassium carbonate 、 potassium iodide 作用下， 以 乙腈 为溶剂， 反应 48.0h， 以67%的产率得到N-[4-[6-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxyhexoxy]phenyl]-2-[[5,11,17,23-tetratert-butyl-26,28-dihydroxy-27-[2-oxo-2-[4-[6-(3,6,7,10,11-pentapentoxytriphenylen-2-yl)oxyhexoxy]anilino]ethoxy]-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]acetamide
  参考文献：
  名称：

  Novel symmetrical triads of triphenylene-calix[4]arene-triphenylene: synthesis and mesomorphism

  摘要：

  Two novel symmetrical triads of triphenylene-calix[4]arene-triphenylene bridged by aromatic amido or hydrazone spacers were synthesized with stepwise procedures in yields of 67% and 68%, respectively. They exhibited interesting mesomorphic behavior of triphenylene column with calix[4]arene units on ancillary lateral sides. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.01.067

文献信息

• Novel symmetrical triads of triphenylene-calix[4]arene-triphenylene: synthesis and mesomorphism
  作者：Fafu Yang、Bingting Xu、Hongyu Guo、Jianwei Xie

  DOI：10.1016/j.tetlet.2012.01.067

  日期：2012.3

  Two novel symmetrical triads of triphenylene-calix[4]arene-triphenylene bridged by aromatic amido or hydrazone spacers were synthesized with stepwise procedures in yields of 67% and 68%, respectively. They exhibited interesting mesomorphic behavior of triphenylene column with calix[4]arene units on ancillary lateral sides. (C) 2012 Elsevier Ltd. All rights reserved.