methyl 5-(4',6'-dimethoxy-2',3'-diphenylindol-7'-yl)pyrrole-2-carboxylate

• 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: methyl 5-(4',6'-dimethoxy-2',3'-diphenylindol-7'-yl)pyrrole-2-carboxylate
• 英文别名: methyl 5-(4,6-dimethoxy-2,3-diphenyl-1H-indol-7-yl)-1H-pyrrole-2-carboxylate
• 化学式: C₂₈H₂₄N₂O₄
• 分子量: 452.51
• InChiKey: IUMAYBVAJXIMAV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.9
• 重原子数：
  34
• 可旋转键数：
  7
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  76.3
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  5-氧代吡咯烷-2-羧酸乙酯 在 palladium on activated charcoal 三氯氧磷 作用下， 以 various solvent(s) 为溶剂， 反应 48.0h， 生成 methyl 5-(4',6'-dimethoxy-2',3'-diphenylindol-7'-yl)pyrrole-2-carboxylate
  参考文献：
  名称：

  The Vilsmeier synthetic route to indolylpyrroles

  摘要：

  Some 2-(7-indolyl)pyrroles have been synthesised from the 4,6-dimethoxyindoles 4, 19 and 20 using the modified Vilsmeier reaction. The indolylpyrrole 8 was formed by dehydrogenation of the 2-(7-indolyl)pyrroline 7, which was obtained from indole 4, methyl pyrrolidin-2-one-5-carboxylate and bromopyrrolidin-2-one 11 and phosphoryl chloride to give the 3-chloro-2-(7-indolyl)pyrrolines 12, 29 and 30, which undergo subsequent dehydrohalogenation to give the indolylpyrroles 13, 33 and 34. (C) 1997 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(97)00516-4

文献信息

• The Vilsmeier synthetic route to indolylpyrroles
  作者：David StC. Black、Michael C. Bowyer、Naresh Kumar

  DOI：10.1016/s0040-4020(97)00516-4

  日期：1997.6

  Some 2-(7-indolyl)pyrroles have been synthesised from the 4,6-dimethoxyindoles 4, 19 and 20 using the modified Vilsmeier reaction. The indolylpyrrole 8 was formed by dehydrogenation of the 2-(7-indolyl)pyrroline 7, which was obtained from indole 4, methyl pyrrolidin-2-one-5-carboxylate and bromopyrrolidin-2-one 11 and phosphoryl chloride to give the 3-chloro-2-(7-indolyl)pyrrolines 12, 29 and 30, which undergo subsequent dehydrohalogenation to give the indolylpyrroles 13, 33 and 34. (C) 1997 Published by Elsevier Science Ltd.