3-(1,2-二氢吲哚并[1,7-ab][1,5]苯并二氮卓-7(6H)-基)-N,N-二甲基丙烷-1-胺二盐酸 | 82859-89-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 中文名称: 3-(1,2-二氢吲哚并[1,7-ab][1,5]苯并二氮卓-7(6H)-基)-N,N-二甲基丙烷-1-胺二盐酸
• 中文别名: 5-(3-(4-(4-氟苯基)-1-哌嗪基)丙氧基)茚满
• 英文名称: 5-<3-<4-(4-fluorophenyl)-1-piperazinyl>propoxy>indan
• 英文别名: 5-{3-[4-(4-fluorophenyl)-1-piperazinyl]propoxy}indane；5-(3-(4-(4-Fluorophenyl)-1-piperazinyl)propoxy)indan；1-[3-(2,3-dihydro-1H-inden-5-yloxy)propyl]-4-(4-fluorophenyl)piperazine
• CAS: 82859-89-0
• 化学式: C₂₂H₂₇FN₂O
• 分子量: 354.468
• InChiKey: DQAHJZNZWUQWQQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  26
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  15.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  5-茚醇 在 氢氧化钾 、 三乙胺 作用下， 以 水 、 N,N-二甲基甲酰胺 、 叔丁醇 为溶剂， 反应 4.0h， 生成 3-(1,2-二氢吲哚并[1,7-ab][1,5]苯并二氮卓-7(6H)-基)-N,N-二甲基丙烷-1-胺二盐酸
  参考文献：
  名称：

  Synthesis and antianxiety activity of (.omega.-piperazinylalkoxy)indan derivatives

  摘要：

  A series of (omega-piperazinylalkoxy)indan derivatives has been synthesized and screened for potential antianxiety activities. The effect of structural modification of these molecules on activities has been systemically examined. Antianxiety activity was displayed by 5-[3-(4-phenyl-1-piperazinyl)propoxy]indan (2), 5-[3-[4-(4-fluorophenyl)-1-piperazinyl]-propoxy]indan (8), 6-fluoro-5-[3-(4-phenyl-1-piperazinyl)propoxy]indan (33), and 6-methyl-5-[3-(4-phenyl-1-piperazinyl)propoxy]indan (42), as determined in antifighting and anti-morphine tests. These derivatives in antianxiety tests were equipotent or more potent than chlordiazepoxide with less muscle-relaxant effect. They also showed weak neuroleptic-like action.

  DOI：

  10.1021/jm00356a024

文献信息

• Piperazinylalkoxyindanes and acid addition salts thereof
  申请人：MITSUBISHI KASEI CORPORATION

  公开号：EP0021368B1

  公开（公告）日：1982-05-19
• US4339580A
  申请人：——

  公开号：US4339580A

  公开（公告）日：1982-07-13
• Synthesis and antianxiety activity of (.omega.-piperazinylalkoxy)indan derivatives
  作者：Ryoji Kikumoto、Akihiro Tobe、Harukazu Fukami、Mitsuo Egawa

  DOI：10.1021/jm00356a024

  日期：1983.2

  A series of (omega-piperazinylalkoxy)indan derivatives has been synthesized and screened for potential antianxiety activities. The effect of structural modification of these molecules on activities has been systemically examined. Antianxiety activity was displayed by 5-[3-(4-phenyl-1-piperazinyl)propoxy]indan (2), 5-[3-[4-(4-fluorophenyl)-1-piperazinyl]-propoxy]indan (8), 6-fluoro-5-[3-(4-phenyl-1-piperazinyl)propoxy]indan (33), and 6-methyl-5-[3-(4-phenyl-1-piperazinyl)propoxy]indan (42), as determined in antifighting and anti-morphine tests. These derivatives in antianxiety tests were equipotent or more potent than chlordiazepoxide with less muscle-relaxant effect. They also showed weak neuroleptic-like action.