3-(N-succinimido-p-phenylcarboxylate(tetraethoxy)oxy)-4-methylthiophene | 476351-91-4

• 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: 3-(N-succinimido-p-phenylcarboxylate(tetraethoxy)oxy)-4-methylthiophene
• 英文别名: (2,5-Dioxopyrrolidin-1-yl) 4-[2-[2-[2-[2-(4-methylthiophen-3-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]benzoate；(2,5-dioxopyrrolidin-1-yl) 4-[2-[2-[2-[2-(4-methylthiophen-3-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]benzoate
• CAS: 476351-91-4
• 化学式: C₂₄H₂₉NO₉S
• 分子量: 507.562
• InChiKey: APMGOTFYEFSCRA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  35
• 可旋转键数：
  17
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  138
• 氢给体数：
  0
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  过氧化氢酶 在 4-二甲氨基吡啶 、 sodium hydroxide 、 potassium carbonate 、 N,N'-二环己基碳二亚胺 、 potassium iodide 作用下， 以 乙醇 、 二氯甲烷 、 丙酮 为溶剂， 反应 111.0h， 生成 3-(N-succinimido-p-phenylcarboxylate(tetraethoxy)oxy)-4-methylthiophene
  参考文献：
  名称：

  A Versatile Approach to Affinitychromic Polythiophenes

  摘要：

  The preparation of both postfunctionalizable and chromic poly[3-(N-succinimido-p-phenylcarboxylate(tetraethoxy)oxy)-4-methylthiophene] is reported. The N-hydroxysuccinimide ester side group can easily react with different amine-bearing molecules in the solid state to yield a library of new polythiophene derivatives. The resulting polymers can be dissolved in various solvents, and interactions between the side chains (ligands) and different analytes (targets) can be detected from modifications of both the side-chain and the backbone conformations resulting in important color changes (i.e., affinitychromism). This colorimetric polymeric transducer could therefore lead to highly valuable, versatile, and inexpensive tools for highthroughput screening and drug discovery.

  DOI：

  10.1021/ja027387l

文献信息

• A Versatile Approach to Affinitychromic Polythiophenes
  作者：Stéphanie Bernier、Sébastien Garreau、Maïté Béra-Abérem、Catherine Gravel、Mario Leclerc

  DOI：10.1021/ja027387l

  日期：2002.10.1

  The preparation of both postfunctionalizable and chromic poly[3-(N-succinimido-p-phenylcarboxylate(tetraethoxy)oxy)-4-methylthiophene] is reported. The N-hydroxysuccinimide ester side group can easily react with different amine-bearing molecules in the solid state to yield a library of new polythiophene derivatives. The resulting polymers can be dissolved in various solvents, and interactions between the side chains (ligands) and different analytes (targets) can be detected from modifications of both the side-chain and the backbone conformations resulting in important color changes (i.e., affinitychromism). This colorimetric polymeric transducer could therefore lead to highly valuable, versatile, and inexpensive tools for highthroughput screening and drug discovery.