1,5-Methano-2-methyl-2,3,4,5-tetrahydro-1H-2-benzazepino-7-ol, hexylcarbamate | 156693-25-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯氮卓类
• 英文名称: 1,5-Methano-2-methyl-2,3,4,5-tetrahydro-1H-2-benzazepino-7-ol, hexylcarbamate
• 英文别名: 1,5-Methano-2-methyl-2,3,4,5-tetrahydro-1H-2-benzazepin-7-yl n-hexylcarbamate；(9-methyl-9-azatricyclo[6.3.1.02,7]dodeca-2(7),3,5-trien-4-yl) N-hexylcarbamate
• CAS: 156693-25-3
• 化学式: C₁₉H₂₈N₂O₂
• 分子量: 316.444
• InChiKey: KFWGKECULQNZER-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  23
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.63
• 拓扑面积：
  41.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  4-methoxy-9-aza-tricyclo[6.3.1.0*2,7*]dodeca-2.4,6-trien-10-one 在 吡啶 、 硼烷四氢呋喃络合物 、 dimethyl sulfide borane 、 氢溴酸 、 sodium hydride 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 7.5h， 生成 1,5-Methano-2-methyl-2,3,4,5-tetrahydro-1H-2-benzazepino-7-ol, hexylcarbamate
  参考文献：
  名称：

  Syntheses and Anticholinesterase Activity of Tetrahydrobenzazepine Carbamates

  摘要：

  The synthesis of a series of alkylcarbamates of 1,5-methano-2,3,4,5-tetrahydro-1H-2-benzazepin-7-ol is reported. Many of these compounds are potent acetylcholinesterase (AChE) inhibitors. The in vitro AChE inhibition, cholinergic effects, acute toxicity, and elevation of brain acetylcholine levels in vivo of this series of compounds are described, A representative compound, 1d (5,6 mg/kg, po), was able to reverse hemicolinium-3-induced amnesia in the mouse passive avoidance assay.

  DOI：

  10.1021/jm00039a013

文献信息

• CHEN, YUHPYNG L.
  作者：CHEN, YUHPYNG L.

  DOI：——

  日期：——
• Syntheses and Anticholinesterase Activity of Tetrahydrobenzazepine Carbamates
  作者：Yuhpyng L. Chen、Dane Liston、Jann Nielsen、Douglas Chapin、Audrey Dunaiskis、Kirk Hedberg、Jeffery Ives、Jonathan Jr. Johnson、Shawn Jones

  DOI：10.1021/jm00039a013

  日期：1994.6

  The synthesis of a series of alkylcarbamates of 1,5-methano-2,3,4,5-tetrahydro-1H-2-benzazepin-7-ol is reported. Many of these compounds are potent acetylcholinesterase (AChE) inhibitors. The in vitro AChE inhibition, cholinergic effects, acute toxicity, and elevation of brain acetylcholine levels in vivo of this series of compounds are described, A representative compound, 1d (5,6 mg/kg, po), was able to reverse hemicolinium-3-induced amnesia in the mouse passive avoidance assay.