N-(2-(2-(2-t-butoxycarbonylaminoethoxy)ethoxy)ethyl)-10,12-pentacosadiynamide | 866132-87-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: N-(2-(2-(2-t-butoxycarbonylaminoethoxy)ethoxy)ethyl)-10,12-pentacosadiynamide
• 英文别名: tert-butyl N-[2-[2-[2-(pentacosa-10,12-diynoylamino)ethoxy]ethoxy]ethyl]carbamate
• CAS: 866132-87-8
• 化学式: C₃₆H₆₄N₂O₅
• 分子量: 604.915
• InChiKey: SVWYVUUSWDTPDG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.1
• 重原子数：
  43.0
• 可旋转键数：
  27.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  85.89
• 氢给体数：
  2.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  N-(2-(2-(2-t-butoxycarbonylaminoethoxy)ethoxy)ethyl)-10,12-pentacosadiynamide 在 盐酸 作用下， 以 二氯甲烷 为溶剂， 反应 0.5h， 以100%的产率得到N-(2-(2-(2-aminoethoxy)ethoxy)ethyl)-10,12-pentacosadiynamide hydrochloride
  参考文献：
  名称：

  Lipophilic peptide nucleic acids containing a 1,3-diyne function: synthesis, characterization and production of derived polydiacetylene liposomes

  摘要：

  Adenine-, cytosine- and thymine-containing peptide nucleic acid (PNA) monomers have been synthesized in which either diacetylenic or stearoyl moieties are attached to the N-or C-terminus; the diacetylenic group is embedded within a long hydrocarbon chain. A range of analogous lipophilic functionalized PNA oligomers have been prepared using either solid phase synthesis or a post-synthetic solution phase procedure following cleavage of the PNA oligomer from the solid Support. Selected functionalized PNA monomers and oligomers have been incorporated into liposomal polydiacetylenes and characterized by UV-vis absorption spectroscopy. Preliminary investigations show that blue PDA-liposomes containing thymine-based PNAs can be formed and that production of liposomes with other PNA systems are viable. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2005.07.021
• 作为产物：
  描述：

  1,8-二氨基-3,6-二氧杂辛烷 以 乙醚 、 二氯甲烷 为溶剂， 反应 19.5h， 生成 N-(2-(2-(2-t-butoxycarbonylaminoethoxy)ethoxy)ethyl)-10,12-pentacosadiynamide
  参考文献：
  名称：

  Lipophilic peptide nucleic acids containing a 1,3-diyne function: synthesis, characterization and production of derived polydiacetylene liposomes

  摘要：

  Adenine-, cytosine- and thymine-containing peptide nucleic acid (PNA) monomers have been synthesized in which either diacetylenic or stearoyl moieties are attached to the N-or C-terminus; the diacetylenic group is embedded within a long hydrocarbon chain. A range of analogous lipophilic functionalized PNA oligomers have been prepared using either solid phase synthesis or a post-synthetic solution phase procedure following cleavage of the PNA oligomer from the solid Support. Selected functionalized PNA monomers and oligomers have been incorporated into liposomal polydiacetylenes and characterized by UV-vis absorption spectroscopy. Preliminary investigations show that blue PDA-liposomes containing thymine-based PNAs can be formed and that production of liposomes with other PNA systems are viable. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2005.07.021