3-(2,5-dioxopyrrolidin-3-yl)-5-(2-phenylethyl)-1H-indole | 889108-58-1

• 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: 3-(2,5-dioxopyrrolidin-3-yl)-5-(2-phenylethyl)-1H-indole
• CAS: 889108-58-1
• 化学式: C₂₀H₁₈N₂O₂
• 分子量: 318.375
• InChiKey: ZOXSGEMFHUZJJZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.08
• 重原子数：
  24.0
• 可旋转键数：
  4.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  61.96
• 氢给体数：
  2.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  3-(2,5-dioxopyrrolidin-3-yl)-5-(2-phenylethyl)-1H-indole 在 2,3-二氯-5,6-二氰基-1,4-苯醌 作用下， 以 1,4-二氧六环 为溶剂， 反应 3.0h， 以88%的产率得到3-(2,5-dihydro-2,5-dioxopyrrol-3-yl)-5-(2-phenylethyl)-1H-indole
  参考文献：
  名称：

  Synthesis and biological evaluation of new dipyrrolo[3,4-a:3,4-c]carbazole-1,3,4,6-tetraones, substituted with various saturated and unsaturated side chains via palladium catalyzed cross-coupling reactions

  摘要：

  The syntheses of a series of dipyrrolo[3,4-a:3,4-c]carbazole-1,3,4,6-tetraoties, substituted in 10-position with saturated and unsaturated side chains, via palladium catalyzed cross-coupling reactions, are described. These compounds call be considered as granulatimide bis-imide analogues. Their inhibitory activity toward Chk1 kinase and their antiproliferative activities in vitro in four tumor cell lines are reported. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2006.01.030
• 作为产物：
  描述：

  5-碘吲哚 在 palladium on activated charcoal 、 四(三苯基膦)钯 copper(l) iodide 、 氢气 、 溶剂黄146 、 三乙胺 作用下， 以 甲醇 、 乙腈 为溶剂， 反应 64.0h， 生成 3-(2,5-dioxopyrrolidin-3-yl)-5-(2-phenylethyl)-1H-indole
  参考文献：
  名称：

  Synthesis and biological evaluation of new dipyrrolo[3,4-a:3,4-c]carbazole-1,3,4,6-tetraones, substituted with various saturated and unsaturated side chains via palladium catalyzed cross-coupling reactions

  摘要：

  The syntheses of a series of dipyrrolo[3,4-a:3,4-c]carbazole-1,3,4,6-tetraoties, substituted in 10-position with saturated and unsaturated side chains, via palladium catalyzed cross-coupling reactions, are described. These compounds call be considered as granulatimide bis-imide analogues. Their inhibitory activity toward Chk1 kinase and their antiproliferative activities in vitro in four tumor cell lines are reported. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2006.01.030