6,7-dimethoxy-1,2,3,4-tetrahydro-1-naphthaleneacetic acid | 85221-57-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 四氢化萘
• 英文名称: 6,7-dimethoxy-1,2,3,4-tetrahydro-1-naphthaleneacetic acid
• 英文别名: 2-(6,7-Dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)acetic acid
• CAS: 85221-57-4
• 化学式: C₁₄H₁₈O₄
• 分子量: 250.295
• InChiKey: JTNABDZGIQGJIL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  55.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6,7-dimethoxy-1,2,3,4-tetrahydro-1-naphthaleneacetic acid 在 盐酸 、 sodium azide 、 氯甲酸乙酯 、 三乙胺 作用下， 生成 1-(aminomethyl)-6,7-dimethoxytetralin hydrochloride
  参考文献：
  名称：

  1-(Aminomethyl)-6,7-dihydroxytetralin derivatives: synthesis and assessment of dopamine-like effects

  摘要：

  The title compounds were designed as flexible congeners of trans-octahydrobenz[h]isoquinoline, in which the dopamine moiety can exist in the alpha conformation. Extremely low dopamine-like effects in the title series in the cat cardioaccelerator nerve assay paralleled low activity in the trans-octahydrobenz[h]isoquinoline compounds and was consistent with a prior proposal of the presence of a bulky region on the dopamine receptor(s).

  DOI：

  10.1021/jm00360a006
• 作为产物：
  描述：

  ethyl 6,7-dimethoxy-1,2,3,4-tetrahydro-1-naphthaleneacetate 在 sodium hydroxide 作用下， 以 乙醇 为溶剂， 反应 24.0h， 以89%的产率得到6,7-dimethoxy-1,2,3,4-tetrahydro-1-naphthaleneacetic acid
  参考文献：
  名称：

  1-(Aminomethyl)-6,7-dihydroxytetralin derivatives: synthesis and assessment of dopamine-like effects

  摘要：

  The title compounds were designed as flexible congeners of trans-octahydrobenz[h]isoquinoline, in which the dopamine moiety can exist in the alpha conformation. Extremely low dopamine-like effects in the title series in the cat cardioaccelerator nerve assay paralleled low activity in the trans-octahydrobenz[h]isoquinoline compounds and was consistent with a prior proposal of the presence of a bulky region on the dopamine receptor(s).

  DOI：

  10.1021/jm00360a006

文献信息

• [(Arylalkylpiperidine-4-yl)methyl]-2-alpha,3,4,5-tetrahydro-1(2H)-acenaphthylene-1-ones and related compounds, a process for their preparation and their use as medicaments
  申请人：HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED

  公开号：EP0517221B1

  公开（公告）日：1995-12-20
• US5106856A
  申请人：——

  公开号：US5106856A

  公开（公告）日：1992-04-21
• 1-(Aminomethyl)-6,7-dihydroxytetralin derivatives: synthesis and assessment of dopamine-like effects
  作者：Joseph G. Cannon、Zurilma Perez、John Paul Long、Mustafa Ilhan

  DOI：10.1021/jm00360a006

  日期：1983.6

  The title compounds were designed as flexible congeners of trans-octahydrobenz[h]isoquinoline, in which the dopamine moiety can exist in the alpha conformation. Extremely low dopamine-like effects in the title series in the cat cardioaccelerator nerve assay paralleled low activity in the trans-octahydrobenz[h]isoquinoline compounds and was consistent with a prior proposal of the presence of a bulky region on the dopamine receptor(s).