6-(4-methylpiperidin-1-ylmethyl)benzo[4,5]imidazo[1,2-c]quinazoline | 941905-34-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 6-(4-methylpiperidin-1-ylmethyl)benzo[4,5]imidazo[1,2-c]quinazoline
• 英文别名: 6-[(4-Methylpiperidin-1-yl)methyl]benzimidazo[1,2-c]quinazoline；6-[(4-methylpiperidin-1-yl)methyl]benzimidazolo[1,2-c]quinazoline
• CAS: 941905-34-6
• 化学式: C₂₁H₂₂N₄
• 分子量: 330.432
• InChiKey: DPAPSIKYULTIJH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  25
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  33.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  6-(4-methylpiperidin-1-ylmethyl)benzo[4,5]imidazo[1,2-c]quinazoline 在 盐酸 、 水 作用下， 反应 0.08h， 生成 N-[2-(1H-benzoimidazol-2-yl)phenyl]-2-(4-methylpiperidin-1-yl)acetamide hydrochloride
  参考文献：
  名称：

  Synthesis and affinity to DNA of phenylbenzoimidazoles and benzoimidazo[1,2-c]quinazolines

  摘要：

  Novel N-(benzoimidazophenyl)dialkylaminoalkylamides and 6-dialkylaminoalkylbenzojmidazo[1,2-c]quinazolines were prepared as potential interferon inducers and antiviral agents. They were screened for the DNA affinity by the ethidium bromide displacement assay. It was shown that the lg K-a values of the compounds containing tetracyclic benzoimidazo[1,2-c]quinazoline fragment are approximately one order magnitude greater than those of the corresponding acyclic phenylbenzoimidazole derivatives. (C) 2009 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2009.03.004
• 作为产物：
  描述：

  4-甲基哌啶 、 6-chloromethylbenzo[4,5]imidazo[1,2-c]quinazoline 以 N,N-二甲基甲酰胺 为溶剂， 反应 24.0h， 以68%的产率得到6-(4-methylpiperidin-1-ylmethyl)benzo[4,5]imidazo[1,2-c]quinazoline
  参考文献：
  名称：

  Synthesis and affinity to DNA of phenylbenzoimidazoles and benzoimidazo[1,2-c]quinazolines

  摘要：

  Novel N-(benzoimidazophenyl)dialkylaminoalkylamides and 6-dialkylaminoalkylbenzojmidazo[1,2-c]quinazolines were prepared as potential interferon inducers and antiviral agents. They were screened for the DNA affinity by the ethidium bromide displacement assay. It was shown that the lg K-a values of the compounds containing tetracyclic benzoimidazo[1,2-c]quinazoline fragment are approximately one order magnitude greater than those of the corresponding acyclic phenylbenzoimidazole derivatives. (C) 2009 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2009.03.004

文献信息

• Synthesis and affinity to DNA of phenylbenzoimidazoles and benzoimidazo[1,2-c]quinazolines
  作者：Elena A. Lyakhova、Yulia A. Gusyeva、Julia V. Nekhoroshkova、Lev M. Shafran、Sergey A. Lyakhov

  DOI：10.1016/j.ejmech.2009.03.004

  日期：2009.8

  Novel N-(benzoimidazophenyl)dialkylaminoalkylamides and 6-dialkylaminoalkylbenzojmidazo[1,2-c]quinazolines were prepared as potential interferon inducers and antiviral agents. They were screened for the DNA affinity by the ethidium bromide displacement assay. It was shown that the lg K-a values of the compounds containing tetracyclic benzoimidazo[1,2-c]quinazoline fragment are approximately one order magnitude greater than those of the corresponding acyclic phenylbenzoimidazole derivatives. (C) 2009 Elsevier Masson SAS. All rights reserved.