2-Methyl-3-(3,4,5-trimethoxy-phenyl)-2,4-dihydro-pyrrolo[3,4-b]quinolin-9-one | 190580-72-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 2-Methyl-3-(3,4,5-trimethoxy-phenyl)-2,4-dihydro-pyrrolo[3,4-b]quinolin-9-one
• 英文别名: 2-methyl-3-(3,4,5-trimethoxyphenyl)-4H-pyrrolo[3,4-b]quinolin-9-one
• CAS: 190580-72-4
• 化学式: C₂₁H₂₀N₂O₄
• 分子量: 364.401
• InChiKey: VQPBRMUJKMYBBR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  27
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  61.7
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  乙酸酐 、 2-Methyl-3-(3,4,5-trimethoxy-phenyl)-2,4-dihydro-pyrrolo[3,4-b]quinolin-9-one 以 二氯甲烷 为溶剂， 以18%的产率得到1-Acetyl-2-methyl-3-(3,4,5-trimethoxy-phenyl)-2,4-dihydro-pyrrolo[3,4-b]quinolin-9-one
  参考文献：
  名称：

  Synthesis of a Novel Fused Tricyclic Quinolone system via Oxidation of 1,2,3,4-Tetrahydro-β-Carbolines.

  摘要：

  The new pyrrolo[3,4-b]quinolin-9-one system has been synthesized via metachloroperbenzoic acid oxidation of quinolones 5 and 10. These latter compounds were obtained by O-2 oxidation of 1,2,3,4-tetrahydro-beta-carbolines. The unexpected m-CPBA oxidation has been studied in connection with the Polonovski reaction. (C) 1997 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(97)00542-x
• 作为产物：
  描述：

  2-Methyl-3-(3,4,5-trimethoxy-phenyl)-1,2,3,4-tetrahydro-pyrrolo[3,4-b]quinolin-9-one 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 以90%的产率得到2-Methyl-3-(3,4,5-trimethoxy-phenyl)-2,4-dihydro-pyrrolo[3,4-b]quinolin-9-one
  参考文献：
  名称：

  Synthesis of a Novel Fused Tricyclic Quinolone system via Oxidation of 1,2,3,4-Tetrahydro-β-Carbolines.

  摘要：

  The new pyrrolo[3,4-b]quinolin-9-one system has been synthesized via metachloroperbenzoic acid oxidation of quinolones 5 and 10. These latter compounds were obtained by O-2 oxidation of 1,2,3,4-tetrahydro-beta-carbolines. The unexpected m-CPBA oxidation has been studied in connection with the Polonovski reaction. (C) 1997 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(97)00542-x