6-[3-[3-Aminopropyl(methyl)amino]propyl]-6-azatetracyclo[6.5.2.04,15.011,14]pentadeca-1(14),2,4(15),8,10-pentaene-5,7-dione | 167393-72-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 6-[3-[3-Aminopropyl(methyl)amino]propyl]-6-azatetracyclo[6.5.2.04,15.011,14]pentadeca-1(14),2,4(15),8,10-pentaene-5,7-dione
• CAS: 167393-72-8
• 化学式: C₂₁H₂₅N₃O₂
• 分子量: 351.448
• InChiKey: XNYKMJGUEDLEAA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  26
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  66.6
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6-[3-[3-Aminopropyl(methyl)amino]propyl]-6-azatetracyclo[6.5.2.04,15.011,14]pentadeca-1(14),2,4(15),8,10-pentaene-5,7-dione 以 乙醇 、 丙酮 为溶剂， 反应 24.0h， 生成 3-(5,6-acenaphthalimido)propyl-3'-(3-isothiocyanate-1,8-naphthalimido)propylmethylamine
  参考文献：
  名称：

  Bis-naphthalimides. 2. Synthesis and biological activity of 5,6-acenaphthalimidoalkyl-1,8-naphthalimidoalkyl amines

  摘要：

  A series of non-symmetric bis-naphthalimides bearing a conveniently substituted 1,8-naphthalimide and a 5,6-acenaphthalimide chromophore was synthesized and in vitro activities were determined. Although previous studies suggested that the presence of the acenaphthalimide system in the structure enhances aqueous solubility, we found that these compounds were no more soluble or cytotoxic than the homologous symmetric series.

  DOI：

  10.1016/0223-5234(96)88230-4
• 作为产物：
  描述：

  N,N-双(3-氨丙基)甲胺 、 6,7-dihydroindeno[6,7,1-def]isochromene-1,3-dione 以 乙醇 为溶剂， 反应 15.0h， 以46%的产率得到6-[3-[3-Aminopropyl(methyl)amino]propyl]-6-azatetracyclo[6.5.2.04,15.011,14]pentadeca-1(14),2,4(15),8,10-pentaene-5,7-dione
  参考文献：
  名称：

  Bis-naphthalimides. 2. Synthesis and biological activity of 5,6-acenaphthalimidoalkyl-1,8-naphthalimidoalkyl amines

  摘要：

  A series of non-symmetric bis-naphthalimides bearing a conveniently substituted 1,8-naphthalimide and a 5,6-acenaphthalimide chromophore was synthesized and in vitro activities were determined. Although previous studies suggested that the presence of the acenaphthalimide system in the structure enhances aqueous solubility, we found that these compounds were no more soluble or cytotoxic than the homologous symmetric series.

  DOI：

  10.1016/0223-5234(96)88230-4

文献信息

• Bis-naphthalimides. 2. Synthesis and biological activity of 5,6-acenaphthalimidoalkyl-1,8-naphthalimidoalkyl amines
  作者：MF Braña、JM Castellano、M Morán、MJ Pérez de Vega、XD Qian、CA Romerdahl、G Keilhauer

  DOI：10.1016/0223-5234(96)88230-4

  日期：1995.1

  A series of non-symmetric bis-naphthalimides bearing a conveniently substituted 1,8-naphthalimide and a 5,6-acenaphthalimide chromophore was synthesized and in vitro activities were determined. Although previous studies suggested that the presence of the acenaphthalimide system in the structure enhances aqueous solubility, we found that these compounds were no more soluble or cytotoxic than the homologous symmetric series.