ZRS1 | 1191923-43-9

• 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: ZRS1
• 英文别名: Acetoxymethyl 3-(4-(3-chlorophenylamino)quinazolin-6-yl)-1-methyltriaz-2-ene-1-carboxylate；[[[4-(3-chloroanilino)quinazolin-6-yl]diazenyl]-methylcarbamoyl]oxymethyl acetate
• CAS: 1191923-43-9
• 化学式: C₁₉H₁₇ClN₆O₄
• 分子量: 428.835
• InChiKey: RSOLNUPXBUNNJM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  30
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  118
• 氢给体数：
  1
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  iodomethyl 3-(4-((3-chlorophenyl)amino)quinazolin-6-yl)-1-methyltriaz-2-ene-1-carboxylate 、 silver(I) acetate 以 丙酮 为溶剂， 生成 ZRS1
  参考文献：
  名称：

  Design and synthesis of new stabilized combi-triazenes for targeting solid tumors expressing the epidermal growth factor receptor (EGFR) or its closest homologue HER2

  摘要：

  The monoalkyltriazene moiety lends itself well to the design of combi-molecules. However, due to its instability under physiological conditions, efforts were directed towards stabilizing it by grafting a hydrolysable carbamate onto the 3-position. The synthesis and biological activities of these novel N-carbamyl triazenes are described. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.05.060

文献信息

• US7879861B2
  申请人：——

  公开号：US7879861B2

  公开（公告）日：2011-02-01
• Design and synthesis of new stabilized combi-triazenes for targeting solid tumors expressing the epidermal growth factor receptor (EGFR) or its closest homologue HER2
  作者：Zakaria Rachid、Meaghan MacPhee、Christopher Williams、Margarita Todorova、Bertrand Jacques Jean-Claude

  DOI：10.1016/j.bmcl.2009.05.060

  日期：2009.9

  The monoalkyltriazene moiety lends itself well to the design of combi-molecules. However, due to its instability under physiological conditions, efforts were directed towards stabilizing it by grafting a hydrolysable carbamate onto the 3-position. The synthesis and biological activities of these novel N-carbamyl triazenes are described. (C) 2009 Elsevier Ltd. All rights reserved.