| 1428330-27-1

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 哈马拉生物碱
• CAS: 1428330-27-1
• 化学式: C₃₀H₁₈Cl₂N₄O₄
• 分子量: 569.403
• InChiKey: LJQKBIXJMCAEDJ-WMPKNSHKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.45
• 重原子数：
  40.0
• 可旋转键数：
  4.0
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  117.86
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  5-[(2-chlorophenyl)(5-nitro-1H-indol-3-yl)methyl]1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione 在 溶剂黄146 作用下， 反应 20.0h， 生成 、
  参考文献：
  名称：

  Substituted dibenzo[2,3:5,6]-pyrrolizino[1,7-bc]indolo[1,2,3-lm]carbazoles: a series of new electron donors

  摘要：

  The synthesis and spectroscopic properties of a series of new organic electron donors derived from dibenzo[2,3:5,6]pyrrolizino-[1,7-bc]indolo[1,2,3-lm]carbazole are described. These compounds can be considered as planar hybrids of carbazole and p-phenylenediamine and possess high thermal stability. The electron donating properties and one- and two-photon spectroscopic features of methoxy derivatives are very sensitive to the number and positions of the methoxy groups. The X-ray structure of the 2,11-dimethoxy derivatives features slipped pi-stacks and short interplanar distance between the molecules in the stacks similar to those found in the unsubstituted derivative. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2013.02.007