5-(dimethylamino)-N-[3-[3-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxy]-2-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxymethyl]-2-isocyanatopropoxy]propyl]naphthalene-1-sulfonamide | 683764-53-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 5-(dimethylamino)-N-[3-[3-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxy]-2-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxymethyl]-2-isocyanatopropoxy]propyl]naphthalene-1-sulfonamide
• CAS: 683764-53-6
• 化学式: C₅₀H₆₃N₇O₁₀S₃
• 分子量: 1018.29
• InChiKey: KHGGJRBEPKMXOQ-UHFFFAOYSA-N

物化性质

• 沸点：
  1073.0±75.0 °C(Predicted)
• 密度：
  1.28±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  7.6
• 重原子数：
  70
• 可旋转键数：
  28
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  231
• 氢给体数：
  3
• 氢受体数：
  17

反应信息

• 作为反应物：
  描述：

  dabsyl chloride 、 5-(dimethylamino)-N-[3-[3-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxy]-2-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxymethyl]-2-isocyanatopropoxy]propyl]naphthalene-1-sulfonamide 、 alkaline earth salt of/the/ methylsulfuric acid 以32%的产率得到
  参考文献：
  名称：

  Dendrimers and combinatorial chemistry—tools for fluorescent enhancement in protease assays

  摘要：

  FRET based systems are some of the best methods available to detect and monitor proteolytic activity. To enhance fluorescent signals and hence assay sensitivity, two different systems were developed using two different dendrimeric constructs. In the first case, a triple branched dendrimer bearing three dansyl groups was used to enhance assay sensitivity and showed a significant enhancement of fluorescence following enzymatic cleavage. In another example, a tris-fluorescein probe, that undergoes self-quenching, was utilized in a combinatorial library synthesis to map the substrate specificity of proteases. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2004.05.105
• 作为产物：
  描述：

  tris(cyanoethoxymethyl)aminomethane 在 4-二甲氨基吡啶 、 硼烷四氢呋喃络合物 、 三乙胺 、 三氟乙酸 作用下， 以 四氢呋喃 、 1,4-二氧六环 、 甲醇 、 二氯甲烷 为溶剂， 反应 104.25h， 生成 5-(dimethylamino)-N-[3-[3-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxy]-2-[3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propoxymethyl]-2-isocyanatopropoxy]propyl]naphthalene-1-sulfonamide
  参考文献：
  名称：

  Assay amplification-multiple valent fluorophores

  摘要：

  通过酶解作用后，聚分支内部淬灭的荧光多肽的合成实现了信号放大。

  DOI：

  10.1039/b308421c

文献信息

• Assay amplification-multiple valent fluorophores
  作者：M. Ternon、M. Bradley

  DOI：10.1039/b308421c

  日期：——

  The synthesis of a dendrimeric, internally quenched, fluorogenic peptide allowed signal amplification following enzymatic cleavage.

  通过酶解作用后，聚分支内部淬灭的荧光多肽的合成实现了信号放大。
• Dendrimers and combinatorial chemistry—tools for fluorescent enhancement in protease assays
  作者：Michaël Ternon、Juan José Dı́az-Mochón、Adam Belsom、Mark Bradley

  DOI：10.1016/j.tet.2004.05.105

  日期：2004.9

  FRET based systems are some of the best methods available to detect and monitor proteolytic activity. To enhance fluorescent signals and hence assay sensitivity, two different systems were developed using two different dendrimeric constructs. In the first case, a triple branched dendrimer bearing three dansyl groups was used to enhance assay sensitivity and showed a significant enhancement of fluorescence following enzymatic cleavage. In another example, a tris-fluorescein probe, that undergoes self-quenching, was utilized in a combinatorial library synthesis to map the substrate specificity of proteases. (C) 2004 Elsevier Ltd. All rights reserved.