trans-6,7-dimethoxy-4-phenyl-2-hydroxytetralin | 146655-89-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 四氢化萘
• 英文名称: trans-6,7-dimethoxy-4-phenyl-2-hydroxytetralin
• 英文别名: (2S,4R)-6,7-dimethoxy-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-ol
• CAS: 146655-89-2；146655-92-7；150402-76-9；150402-84-9
• 化学式: C₁₈H₂₀O₃
• 分子量: 284.355
• InChiKey: UCDARZFMZAFHPW-HUUCEWRRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  38.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  trans-6,7-dimethoxy-4-phenyl-2-hydroxytetralin 在 吡啶 、 sodium azide 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.75h， 生成 (1R,3R)-3-azido-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydronaphthalene
  参考文献：
  名称：

  Dopamine receptor agonists. I. Synthesis and pharmacological evaluation of 4-aryl-substituted analogues of 6,7-dihydroxy-2-amino tetralin (6,7-ADTN) and related indane compounds

  摘要：

  Derivatives of cis- and trans-4-phenyl-6,7-dihydroxy-2-aminotetraline and trans-1-phenyl-5,6-dihydroxy-2-aminoindane were synthetized as fenoldopam analogues. They showed no affinity for D, and D2 binding sites in rat striatal membranes. Molecular modeling and NMR methods used in structural comparison with fenoldopam are discussed.

  DOI：

  10.1016/0223-5234(92)90086-g
• 作为产物：
  描述：

  4-(3,4-dimethoxyphenyl)-1-phenyl-1-buten-3-one 在 吡啶 、 sodium tetrahydroborate 、 lithium aluminium tetrahydride 、 PPA 作用下， 以 四氢呋喃 、 水 、 丙酮 为溶剂， 反应 30.75h， 生成 trans-6,7-dimethoxy-4-phenyl-2-hydroxytetralin
  参考文献：
  名称：

  Dopamine receptor agonists. I. Synthesis and pharmacological evaluation of 4-aryl-substituted analogues of 6,7-dihydroxy-2-amino tetralin (6,7-ADTN) and related indane compounds

  摘要：

  Derivatives of cis- and trans-4-phenyl-6,7-dihydroxy-2-aminotetraline and trans-1-phenyl-5,6-dihydroxy-2-aminoindane were synthetized as fenoldopam analogues. They showed no affinity for D, and D2 binding sites in rat striatal membranes. Molecular modeling and NMR methods used in structural comparison with fenoldopam are discussed.

  DOI：

  10.1016/0223-5234(92)90086-g

文献信息

• Dopamine receptor agonists. I. Synthesis and pharmacological evaluation of 4-aryl-substituted analogues of 6,7-dihydroxy-2-amino tetralin (6,7-ADTN) and related indane compounds
  作者：G Bertolini、V Vecchietti、M Mabilia、G Norcini、A Restelli、F Santangelo、AM Villa、C Casagrande

  DOI：10.1016/0223-5234(92)90086-g

  日期：1992.10

  Derivatives of cis- and trans-4-phenyl-6,7-dihydroxy-2-aminotetraline and trans-1-phenyl-5,6-dihydroxy-2-aminoindane were synthetized as fenoldopam analogues. They showed no affinity for D, and D2 binding sites in rat striatal membranes. Molecular modeling and NMR methods used in structural comparison with fenoldopam are discussed.