dimethyl 1-(4-ethoxyphenyl)-4-(4-methylbenzoyl)-1H-pyrido[2,3-b]indole-2,3-dicarboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: dimethyl 1-(4-ethoxyphenyl)-4-(4-methylbenzoyl)-1H-pyrido[2,3-b]indole-2,3-dicarboxylate
• 英文别名: Dimethyl 1-(4-ethoxyphenyl)-4-(4-methylbenzoyl)pyrido[2,3-b]indole-2,3-dicarboxylate；dimethyl 1-(4-ethoxyphenyl)-4-(4-methylbenzoyl)pyrido[2,3-b]indole-2,3-dicarboxylate
• 化学式: C₃₁H₂₆N₂O₆
• 分子量: 522.557
• InChiKey: FDQKKWBAMJPINS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.1
• 重原子数：
  39
• 可旋转键数：
  9
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  96.7
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  3-[2-(4-methylphenyl)-2-oxoethylidene]-1,3-dihydro-2H-indol-2-one 、 对乙氧基苯胺 、 丁炔二酸二甲酯 在 sodium methylate 作用下， 以 甲醇 为溶剂， 以88%的产率得到dimethyl 1-(4-ethoxyphenyl)-4-(4-methylbenzoyl)-1H-pyrido[2,3-b]indole-2,3-dicarboxylate
  参考文献：
  名称：

  Selective Synthesis of Polyfunctionalized Pyrido[2,3-b]indoles by Multicomponent Domino Reactions

  摘要：

  A series of novel polyfunctionalized pyrido[2,3-b]indoles were synthesized by three- or four-component domino reactions under microwave irradiation. This protocol has the advantages of readily available starting materials, short reaction times, high yields, easy workup, and high chemo- and regioselectivities.

  DOI：

  10.1021/jo501049m

文献信息

• Selective Synthesis of Polyfunctionalized Pyrido[2,3-<i>b</i>]indoles by Multicomponent Domino Reactions
  作者：Jun-Die Hu、Cheng-Pao Cao、Wei Lin、Ming-Hua Hu、Zhi-Bin Huang、Da-Qing Shi

  DOI：10.1021/jo501049m

  日期：2014.9.5

  A series of novel polyfunctionalized pyrido[2,3-b]indoles were synthesized by three- or four-component domino reactions under microwave irradiation. This protocol has the advantages of readily available starting materials, short reaction times, high yields, easy workup, and high chemo- and regioselectivities.