(+)-(S)-2-(2-methoxy-1,4-benzodioxan-2-yl)-2-imidazoline | 89195-31-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并二恶烷
• 英文名称: (+)-(S)-2-(2-methoxy-1,4-benzodioxan-2-yl)-2-imidazoline
• 英文别名: 2-Methoxyidazoxan, (S)-；2-[(3S)-3-methoxy-2H-1,4-benzodioxin-3-yl]-4,5-dihydro-1H-imidazole
• CAS: 89195-31-3
• 化学式: C₁₂H₁₄N₂O₃
• 分子量: 234.255
• InChiKey: HQGWKNGAKBPTBX-GFCCVEGCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  52.1
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-甲氧基聚硅氧烷 生成 (+)-(S)-2-(2-methoxy-1,4-benzodioxan-2-yl)-2-imidazoline
  参考文献：
  名称：

  .alpha.-Adrenoreceptor reagents. 4. Resolution of some potent selective prejunctional .alpha.2-adrenoreceptor antagonists

  摘要：

  The resolution of three 2-substituted derivatives of idazoxan is described. The enantiomers show large separations in activity in a variety of in vitro and in vivo tests, and the active isomers are all potent and selective antagonists at the alpha 2-adrenoreceptor. The significance of these results in relation to those published on the enantiomers of idazoxan and to those on optically active alpha 2-adrenoreceptor agonists is discussed.

  DOI：

  10.1021/jm00160a033

文献信息

• STILLINGS, M. R.
  作者：STILLINGS, M. R.

  DOI：——

  日期：——
• .alpha.-Adrenoreceptor reagents. 4. Resolution of some potent selective prejunctional .alpha.2-adrenoreceptor antagonists
  作者：Anthony P. Welbourn、Christopher B. Chapleo、Anthony C. Lane、Peter L. Myers、Alan G. Roach、Colin F. C. Smith、Michael R. Stillings、Ian F. Tulloch

  DOI：10.1021/jm00160a033

  日期：1986.10.1

  The resolution of three 2-substituted derivatives of idazoxan is described. The enantiomers show large separations in activity in a variety of in vitro and in vivo tests, and the active isomers are all potent and selective antagonists at the alpha 2-adrenoreceptor. The significance of these results in relation to those published on the enantiomers of idazoxan and to those on optically active alpha 2-adrenoreceptor agonists is discussed.