(5-(4-amino-6,7-dimethoxyquinazolin-2-ylamino)-2-hydroxyphenyl)-N,N,N-trimethylmethanaminium iodide | 955092-70-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (5-(4-amino-6,7-dimethoxyquinazolin-2-ylamino)-2-hydroxyphenyl)-N,N,N-trimethylmethanaminium iodide
• 英文别名: [5-[(4-Amino-6,7-dimethoxyquinazolin-2-yl)amino]-2-hydroxyphenyl]methyl-trimethylazanium;iodide
• CAS: 955092-70-3
• 化学式: C₂₀H₂₆N₅O₃*I
• 分子量: 511.363
• InChiKey: SYEOJSLSAZBOOX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.11
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  103
• 氢给体数：
  3
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  4-(4-amino-6,7-dimethoxyquinazolin-2-ylamino)-2-((dimethylamino)methyl)phenol 、 碘甲烷 以 乙腈 为溶剂， 反应 12.0h， 以93%的产率得到(5-(4-amino-6,7-dimethoxyquinazolin-2-ylamino)-2-hydroxyphenyl)-N,N,N-trimethylmethanaminium iodide
  参考文献：
  名称：

  Synthesis and biological activities of quinazoline derivatives with ortho-phenol-quaternary ammonium salt groups

  摘要：

  One phenol-quaternary ammonium salt derivative with a flexible linker and three derivatives with a quinazoline moiety are present. Their binding affinities for DNA are discussed and it is clearly demonstrated that this class of phenol-quaternary ammonium salt derivatives could inhibit DNA transcription effectively. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2007.07.053

文献信息

• Synthesis and biological activities of quinazoline derivatives with ortho-phenol-quaternary ammonium salt groups
  作者：Lixia Zhang、Lige Ren、Minghui Bai、Liwei Weng、Jing Huang、Lin Wu、Minggang Deng、Xiang Zhou

  DOI：10.1016/j.bmc.2007.07.053

  日期：2007.11

  One phenol-quaternary ammonium salt derivative with a flexible linker and three derivatives with a quinazoline moiety are present. Their binding affinities for DNA are discussed and it is clearly demonstrated that this class of phenol-quaternary ammonium salt derivatives could inhibit DNA transcription effectively. (C) 2007 Elsevier Ltd. All rights reserved.