(R,S) 2-(7-ethyl-1,2,3,4-tetrahydronaphth-1-yl)ethylamine hydrochloride

• 分子结构分类: 有机化合物 - 苯类化合物 - 四氢化萘
• 英文名称: (R,S) 2-(7-ethyl-1,2,3,4-tetrahydronaphth-1-yl)ethylamine hydrochloride
• 英文别名: 2-(7-Ethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine;hydrochloride
• 化学式: C₁₄H₂₁N*ClH
• 分子量: 239.788
• InChiKey: AWKMCOYGGOQPPB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.44
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  26
• 氢给体数：
  2
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  (R,S) 2-(7-ethyl-1,2,3,4-tetrahydronaphth-1-yl)ethylamine hydrochloride 、 环丁基甲酰氯 在 potassium carbonate 作用下， 以 二氯甲烷 为溶剂， 以82%的产率得到(R,S) 2-(7-ethyl-1,2,3,4-tetrahydronaphth-1-yl)ethylcyclobutylcarboxamide
  参考文献：
  名称：

  Tetrahydronaphthalenic derivatives as new agonist and antagonist ligands for melatonin receptors

  摘要：

  Tetrahydronaphthalenic ligands were synthesized and evaluated as melatonin receptor ligands. Biological studies show that the aromaticity of the ring bearing the side chain is not essential for affinity and activity and that replacement of the methoxy group with the bioisostere ethyl which does not offer the possibility of H-bonding, leads to antagonist or forskoline potentiating properties. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(97)00175-2
• 作为产物：
  描述：

  7-乙基-3,4-二氢-2H-1-萘酮 在 镍 氨 、 氢气 、 sodium hydride 作用下， 以 四氢呋喃 、 乙醇 为溶剂， 生成 (R,S) 2-(7-ethyl-1,2,3,4-tetrahydronaphth-1-yl)ethylamine hydrochloride
  参考文献：
  名称：

  Tetrahydronaphthalenic derivatives as new agonist and antagonist ligands for melatonin receptors

  摘要：

  Tetrahydronaphthalenic ligands were synthesized and evaluated as melatonin receptor ligands. Biological studies show that the aromaticity of the ring bearing the side chain is not essential for affinity and activity and that replacement of the methoxy group with the bioisostere ethyl which does not offer the possibility of H-bonding, leads to antagonist or forskoline potentiating properties. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(97)00175-2

文献信息

• US5693665A
  申请人：——

  公开号：US5693665A

  公开（公告）日：1997-12-02
• US5780512A
  申请人：——

  公开号：US5780512A

  公开（公告）日：1998-07-14
• Tetrahydronaphthalenic derivatives as new agonist and antagonist ligands for melatonin receptors
  作者：E. Fourmaintraux、P. Depreux、D. Lesieur、B. Guardiola-Lemaître、C. Bennejean、P. Delagrange、H.E. Howell

  DOI：10.1016/s0968-0896(97)00175-2

  日期：1998.1

  Tetrahydronaphthalenic ligands were synthesized and evaluated as melatonin receptor ligands. Biological studies show that the aromaticity of the ring bearing the side chain is not essential for affinity and activity and that replacement of the methoxy group with the bioisostere ethyl which does not offer the possibility of H-bonding, leads to antagonist or forskoline potentiating properties. (C) 1998 Elsevier Science Ltd. All rights reserved.