{({2-[2-(2-Amino-ethoxy)-ethoxy]-ethylcarbamoyl}-methyl)-[2-(bis-ethoxycarbonylmethyl-amino)-ethyl]-amino}-acetic acid ethyl ester | 351154-66-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: {({2-[2-(2-Amino-ethoxy)-ethoxy]-ethylcarbamoyl}-methyl)-[2-(bis-ethoxycarbonylmethyl-amino)-ethyl]-amino}-acetic acid ethyl ester
• CAS: 351154-66-0
• 化学式: C₂₂H₄₂N₄O₉
• 分子量: 506.597
• InChiKey: NEKUMRFVCHYCGO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.61
• 重原子数：
  35.0
• 可旋转键数：
  22.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  158.96
• 氢给体数：
  2.0
• 氢受体数：
  12.0

反应信息

• 作为反应物：
  描述：

  {({2-[2-(2-Amino-ethoxy)-ethoxy]-ethylcarbamoyl}-methyl)-[2-(bis-ethoxycarbonylmethyl-amino)-ethyl]-amino}-acetic acid ethyl ester 在 lithium hydroxide 、 (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate 、 三乙胺 作用下， 以 四氢呋喃 、 甲醇 、 氯仿 、 乙腈 为溶剂， 反应 28.0h， 生成
  参考文献：
  名称：

  Synthesis of Conjugated Diacetylene, Metal-Chelating Monomers for Polymerizable Monolayer Assemblies

  摘要：

  [GRAPHICS]Self-assembled monolayers (SAMs) of thiols on gold have been used for numerous applications. For protein targeting applications, one successful strategy is to use a metal chelating SAM. It has also been demonstrated that polymerized SAMs are much more stable than non polymerized counterparts. We report herein, the synthesis of several polymerizable, metal-chelating thiols capable of complexing luminescent lanthanide ions.

  DOI：

  10.1021/ol015931+
• 作为产物：
  描述：

  {({2-[2-(2-Benzyloxycarbonylamino-ethoxy)-ethoxy]-ethylcarbamoyl}-methyl)-[2-(bis-ethoxycarbonylmethyl-amino)-ethyl]-amino}-acetic acid ethyl ester 在 钯 盐酸 、 氢气 作用下， 以 甲醇 为溶剂， 反应 16.0h， 以96%的产率得到{({2-[2-(2-Amino-ethoxy)-ethoxy]-ethylcarbamoyl}-methyl)-[2-(bis-ethoxycarbonylmethyl-amino)-ethyl]-amino}-acetic acid ethyl ester
  参考文献：
  名称：

  Synthesis of Conjugated Diacetylene, Metal-Chelating Monomers for Polymerizable Monolayer Assemblies

  摘要：

  [GRAPHICS]Self-assembled monolayers (SAMs) of thiols on gold have been used for numerous applications. For protein targeting applications, one successful strategy is to use a metal chelating SAM. It has also been demonstrated that polymerized SAMs are much more stable than non polymerized counterparts. We report herein, the synthesis of several polymerizable, metal-chelating thiols capable of complexing luminescent lanthanide ions.

  DOI：

  10.1021/ol015931+

文献信息

• Synthesis of New, Pyrene-Containing, Metal-Chelating Lipids and Sensing of Cupric Ions
  作者：Bidhan C. Roy、Binita Chandra、Daniel Hromas、Sanku Mallik

  DOI：10.1021/ol026891s

  日期：2003.1.1

  The syntheses of several saturated, pyrene-containing, metal-chelating lipids are described. These lipids are capable of strongly binding to transition metal ions employing the metal-chelating headgroup. The excimer-to-monomer ratio of the pyrene groups changes with addition of cupric ions to the liposomes. Three other transition metal ions (Zn2+, Ni2+, and Hg2+) did not cause any appreciable changes in the excimer-to-monomer ratio.