3-(2-chloroethoxy)benzoyl chloride | 1078640-86-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-(2-chloroethoxy)benzoyl chloride
• 英文别名: 3-(2-Chloroethoxy)benzoyl chloride
• CAS: 1078640-86-4
• 化学式: C₉H₈Cl₂O₂
• 分子量: 219.067
• InChiKey: SNHWHIPFEDPALQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  13
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-(2-chloroethoxy)benzoyl chloride 、 [7-(4-benzofuran-2-yl-phenoxy)heptyl]benzylmethylamine 在 四氯化锡 作用下， 以 二氯甲烷 为溶剂， 以54%的产率得到(2-{4-[7-(benzyl-N-methylamino)heptyloxy]phenyl}benzofuran-3-yl)-[3-(2-chloroethoxy)phenyl]methanone
  参考文献：
  名称：

  2-Arylbenzofuran-based molecules as multipotent Alzheimer's disease modifying agents

  摘要：

  The complex etiology of Alzheimer's disease prompts scientists to develop multi-target strategies to combat causes and symptoms. In line with this modern paradigm and as a follow-up to our previous studies, we designed and synthesized a focused collection of new 2-arylbenzofurans and evaluated their biological properties towards specific targets involved in AD, namely human AChE and human BuChE, and A beta fibril formation. Selected compounds were also tested for their ability to inhibit A beta neurotoxicity in terms of neuronal viability loss, and to prevent A beta peptide-binding to cell membrane and intracellular reactive oxygen species (ROS) formation. The different modifications introduced in the structure of our lead compound led to an increase in activity towards one or more of the selected targets: the anticholinesterase activity of some compounds was found to be significantly higher than previously obtained related molecules, and the compounds also proved to possess A beta anti-aggregating properties and neuroprotective effects. The most interesting multi-target compounds were 18, and 1. Interestingly, 1 also showed good selectivity and moderate affinity for CB1 receptor, opening new perspectives in the field of research on AD, since cannabinoid ligands have been widely reported to have neuroprotective properties. (C) 2012 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2012.10.045

文献信息

• Benzoxazepine derivatives as selective estrogen receptor modulators
  申请人：Lanter C. James

  公开号：US20060040917A1

  公开（公告）日：2006-02-23

  The present invention is directed to novel benzoxazepine derivatives, pharmaceutical compositions containing them and their use in the treatment of disorders and diseases mediated by an estrogen receptor.

  本发明涉及新型苯并噁唑啉衍生物，含有它们的药物组合物以及它们在治疗由雌激素受体介导的疾病和疾病中的应用。
• BENZOXAZEPINE DERIVATIVES AS SELECTIVE ESTROGEN RECEPTOR MODULATORS
  申请人：JANSSEN PHARMACEUTICA N.V.

  公开号：EP1778656A1

  公开（公告）日：2007-05-02
• [EN] BENZOXAZEPINE DERIVATIVES AS SELECTIVE ESTROGEN RECEPTOR MODULATORS<br/>[FR] DERIVES DE BENZOXAZEPINE COMME MODULATEURS SELECTIFS DU RECEPTEUR D'OETROGENE
  申请人：JANSSEN PHARMACEUTICA NV

  公开号：WO2006023242A1

  公开（公告）日：2006-03-02

  The present invention is directed to novel benzoxazepine derivatives, pharmaceutical compositions containing them and their use in the treatment of disorders and diseases mediated by an estrogen receptor.