tetraaza-calix[2]arene[2](4-methoxy)triazine | 862472-06-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 英文名称: tetraaza-calix[2]arene[2](4-methoxy)triazine
• 英文别名: 5,17-Dimethoxy-2,4,6,8,14,16,18,20,26,28-decazapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaene；5,17-dimethoxy-2,4,6,8,14,16,18,20,26,28-decazapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaene
• CAS: 862472-06-8
• 化学式: C₂₀H₁₈N₁₀O₂
• 分子量: 430.429
• InChiKey: XYOLLWNWOODPOS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  32
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  159
• 氢给体数：
  4
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  1-N,3-N-bis(4-chloro-6-methoxy-1,3,5-triazin-2-yl)benzene-1,3-diamine 、 间苯二胺 在 N,N-二异丙基乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 72.0h， 以68%的产率得到tetraaza-calix[2]arene[2](4-methoxy)triazine
  参考文献：
  名称：

  Synthesis of Aza-Bridged Calix(4-methoxy)triazines toward Flattened π-Conjugated Macrocycles

  摘要：

  Calixtriazines containing a 4-alkoxy-1,3,5-triazine backbone were efficiently synthesized by sequential fragment coupling started from 4-alkoxy-2,6-dichrolo-1,3,5-triazine. These macrocycles tend to form flattened conformations, leading to a stable pi-conjugated system, presumably due to the electronic features of the alkoxy-substituent on the triazine rings.

  DOI：

  10.3987/com-08-s(d)24

文献信息

• Synthesis of Aza-Bridged Calix(4-methoxy)triazines toward Flattened π-Conjugated Macrocycles
  作者：Munetaka Kunishima、Hiroyuki Tanaka、Ayako Wada、Kazuhito Hioki、Daiki Morisaki、Motoo Shiro

  DOI：10.3987/com-08-s(d)24

  日期：——

  Calixtriazines containing a 4-alkoxy-1,3,5-triazine backbone were efficiently synthesized by sequential fragment coupling started from 4-alkoxy-2,6-dichrolo-1,3,5-triazine. These macrocycles tend to form flattened conformations, leading to a stable pi-conjugated system, presumably due to the electronic features of the alkoxy-substituent on the triazine rings.