5-(dimethylamino)-N-{tris[(2-carboxyethoxy)methyl]methyl}naphthalene-1-sulfonamide | 493007-03-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 5-(dimethylamino)-N-{tris[(2-carboxyethoxy)methyl]methyl}naphthalene-1-sulfonamide
• 英文别名: 3-[3-(2-Carboxyethoxy)-2-(2-carboxyethoxymethyl)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxy]propanoic acid
• CAS: 493007-03-7
• 化学式: C₂₅H₃₄N₂O₁₁S
• 分子量: 570.618
• InChiKey: XJVBLXSMHKGBRY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  39
• 可旋转键数：
  19
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.48
• 拓扑面积：
  197
• 氢给体数：
  4
• 氢受体数：
  13

反应信息

• 作为反应物：
  描述：

  三[[2-(叔-丁氧羰基)乙氧基]甲基]甲胺 、 5-(dimethylamino)-N-{tris[(2-carboxyethoxy)methyl]methyl}naphthalene-1-sulfonamide 在 1-羟基苯并三唑 、 1-(3-二甲基氨基丙基)-3-乙基碳二亚胺 、 三乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 22.0h， 以82%的产率得到5-(dimethylamino)-N-{tris[(2-{[(tris{[2-(tert-butoxycarbonyl)ethoxy]methyl}methyl)amino]carbonyl}ethoxy)methyl]methyl}naphthalene-1-sulfonamide
  参考文献：
  名称：

  Spatially Resolved Derivatization of Solid-Phase-Synthesis Beads with Fluorescent Dendrimers: Creation of Localized Microdomains

  摘要：

  Second and third generation Newkome-type trifurcated dendrimers, containing either a coumarin or dansyl fluorescent probe at the dendrimer core, have been synthesized and attached to ArgoGel (R) solid-phase-synthesis beads. Subsequent reaction with rhodamine dye shows that the dye can penetrate throughout the beads to acylate the remaining sites. Thus, it is possible to achieve a spatially resolved microdomain for library formation at the core of the dendrimer, primarily on the bead's periphery, and a second microdomain suitable for derivatization by other reagents such as encoding tags and fluorescent sensors.

  DOI：

  10.1002/1522-2675(200210)85:10<3532::aid-hlca3532>3.0.co;2-f
• 作为产物：
  描述：

  三[[2-(叔-丁氧羰基)乙氧基]甲基]甲胺 在 甲酸 、 potassium carbonate 作用下， 以 乙腈 为溶剂， 反应 60.0h， 生成 5-(dimethylamino)-N-{tris[(2-carboxyethoxy)methyl]methyl}naphthalene-1-sulfonamide
  参考文献：
  名称：

  Spatially Resolved Derivatization of Solid-Phase-Synthesis Beads with Fluorescent Dendrimers: Creation of Localized Microdomains

  摘要：

  Second and third generation Newkome-type trifurcated dendrimers, containing either a coumarin or dansyl fluorescent probe at the dendrimer core, have been synthesized and attached to ArgoGel (R) solid-phase-synthesis beads. Subsequent reaction with rhodamine dye shows that the dye can penetrate throughout the beads to acylate the remaining sites. Thus, it is possible to achieve a spatially resolved microdomain for library formation at the core of the dendrimer, primarily on the bead's periphery, and a second microdomain suitable for derivatization by other reagents such as encoding tags and fluorescent sensors.

  DOI：

  10.1002/1522-2675(200210)85:10<3532::aid-hlca3532>3.0.co;2-f