N-[2-(2-propyloxyethoxy)ethyl]diethanolamine | 397246-47-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 氧烷类
• 英文名称: N-[2-(2-propyloxyethoxy)ethyl]diethanolamine
• 英文别名: 2-((2-hydroxy-ethyl)-{2-[2-(tetrahydropyran-2-yloxy)-ethoxy]-ethyl}-amino)-ethanol；Ethanol, 2,2'-[[2-[2-[(tetrahydro-2H-pyran-2-yl)oxy]ethoxy]ethyl]imino]bis-；2-[2-hydroxyethyl-[2-[2-(oxan-2-yloxy)ethoxy]ethyl]amino]ethanol
• CAS: 397246-47-8
• 化学式: C₁₃H₂₇NO₅
• 分子量: 277.361
• InChiKey: ZUDUCQBFRKUPIX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.5
• 重原子数：
  19
• 可旋转键数：
  11
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  71.4
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N-[2-(2-propyloxyethoxy)ethyl]diethanolamine 在 盐酸 、 甲醇 、 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 反应 69.0h， 生成 2-[2-(1,4,7,10,13-pentaoxa-16-azacyclooctadecan-16-yl)ethoxy]ethanol
  参考文献：
  名称：

  Synthesis of azacrown ethers modified with side-chains containing germanium

  摘要：

  The reaction between ethanolamine (4) and tri- or tetraethylene tosylate (5) and (13) gave 9- and 12-membered monoazacrowns with a -CH2CH2OH residue on nitrogen, A-OH and B-OH, together with 18- and 24-membered diazacrown ethers with the same substituent on nitrogen, E-OH and F-OH. If 2-(2-aminoethoxy)ethanol (12) was used in the reaction described above, instead of 4, the final products, G-OH and H-OH, and K-OH and L-OH, have a longer side chain, -CH2CH2OCH2CH2OH, on nitrogen (Route 1). A series of reactions involving bromoethanol (6) and diethanolamine (9) formed, with 5 or 13, 18- and 24-membered monoazacrowns with the shorter substituent as described above, a 15-membered monoazacrown ether C-OH and an 18-membered D-OH. If 2-(2-chloroethoxy)ethanol (14) is used instead of 6, I-OH and J-OH are obtained (Route 2'). All these hydroxy azacrown ethers were made to react with 3-trimethylgermylpropionic acid (18) to give the corresponding germanium-containing A-L. A preliminary investigation was carried out on the cation transport capability of these germanium-containing azacrown ethers to observe whether germanium might enhance their cation transporting capability. (C) 2001 Published by Elsevier Science B.V.

  DOI：

  10.1016/s0022-328x(01)01054-3
• 作为产物：
  描述：

  2-(2-(2-chloroethoxy)ethoxy)tetrahydro-2H-pyran 、 二乙醇胺 在 四丁基溴化铵 sodium carbonate 、 sodium iodide 作用下， 以 DMF (N,N-dimethyl-formamide) 为溶剂， 反应 5.0h， 生成 N-[2-(2-propyloxyethoxy)ethyl]diethanolamine
  参考文献：
  名称：

  [EN] PREPARATION OF QUETIAPINE
  [FR] PREPARATION DE QUETIAPINE

  摘要：

  本发明公开了一种制备喹硫平的方法，包括二苯并[b,f][1,4]噻吩-11-基胺与一般式（II）化合物的反应，以及该过程中的新中间体。

  公开号：

  WO2005028457A1

文献信息

• DEUTERIUM-ENRICHED QUETIAPINE
  申请人：Czarnik Anthony W.

  公开号：US20090082334A1

  公开（公告）日：2009-03-26

  The present application describes deuterium-enriched quetiapine, pharmaceutically acceptable salt forms thereof, and methods of treating using the same.
• Synthesis of azacrown ethers modified with side-chains containing germanium
  作者：Ryoko Suzuki、Takashi Matsumoto、Katsumi Tanaka、Yoshito Takeuchi、Tamotsu Taketomi

  DOI：10.1016/s0022-328x(01)01054-3

  日期：2001.11

  The reaction between ethanolamine (4) and tri- or tetraethylene tosylate (5) and (13) gave 9- and 12-membered monoazacrowns with a -CH2CH2OH residue on nitrogen, A-OH and B-OH, together with 18- and 24-membered diazacrown ethers with the same substituent on nitrogen, E-OH and F-OH. If 2-(2-aminoethoxy)ethanol (12) was used in the reaction described above, instead of 4, the final products, G-OH and H-OH, and K-OH and L-OH, have a longer side chain, -CH2CH2OCH2CH2OH, on nitrogen (Route 1). A series of reactions involving bromoethanol (6) and diethanolamine (9) formed, with 5 or 13, 18- and 24-membered monoazacrowns with the shorter substituent as described above, a 15-membered monoazacrown ether C-OH and an 18-membered D-OH. If 2-(2-chloroethoxy)ethanol (14) is used instead of 6, I-OH and J-OH are obtained (Route 2'). All these hydroxy azacrown ethers were made to react with 3-trimethylgermylpropionic acid (18) to give the corresponding germanium-containing A-L. A preliminary investigation was carried out on the cation transport capability of these germanium-containing azacrown ethers to observe whether germanium might enhance their cation transporting capability. (C) 2001 Published by Elsevier Science B.V.
• [EN] PREPARATION OF QUETIAPINE<br/>[FR] PREPARATION DE QUETIAPINE
  申请人：FERMION OY

  公开号：WO2005028457A1

  公开（公告）日：2005-03-31

  The present invention discloses a process for the preparation of quetiapine, which comprises the reaction of dibenzo[b,f][1,4]thiazepin-11-ylamine with a compound of the general formula (II) as well as novel intermediates in the process.

  本发明公开了一种制备喹硫平的方法，包括二苯并[b,f][1,4]噻吩-11-基胺与一般式（II）化合物的反应，以及该过程中的新中间体。