1-oxo-3-phenyl-2-p-tolyl-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 1-oxo-3-phenyl-2-p-tolyl-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
• 英文别名: 2-(4-methylphenyl)-1-oxo-3-phenyl-3,4-dihydroisoquinoline-4-carboxylic acid
• 化学式: C₂₃H₁₉NO₃
• 分子量: 357.409
• InChiKey: CDVBBRBSRNVKAB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.56
• 重原子数：
  27.0
• 可旋转键数：
  3.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  57.61
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为产物：
  描述：

  苯甲醛 、 乙烷,三氯氟- 、 高邻苯二甲酸酐 在 L-脯氨酸 作用下， 以 乙腈 为溶剂， 反应 2.0h， 以88%的产率得到1-oxo-3-phenyl-2-p-tolyl-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
  参考文献：
  名称：

  l-Proline-catalyzed diastereoselective synthesis of cis-isoquinolonic acids and evaluation of their neuroprotective effects

  摘要：

  L-Proline efficiently catalyzes the one-pot, three-component reaction of homophthalic anhydride, amines, and aldehydes in CH3CN at room temperature, to afford the corresponding cis-isoquinolonic acids in high yields and with excellent diastereoselectivities. The synthesized compounds are screened for neuroprotective activities. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.04.089

文献信息

• l-Proline-catalyzed diastereoselective synthesis of cis-isoquinolonic acids and evaluation of their neuroprotective effects
  作者：Ali Reza Karimi、Hamid Reza Momeni、Rahim Pashazadeh

  DOI：10.1016/j.tetlet.2012.04.089

  日期：2012.7

  L-Proline efficiently catalyzes the one-pot, three-component reaction of homophthalic anhydride, amines, and aldehydes in CH3CN at room temperature, to afford the corresponding cis-isoquinolonic acids in high yields and with excellent diastereoselectivities. The synthesized compounds are screened for neuroprotective activities. (C) 2012 Elsevier Ltd. All rights reserved.