methyl (2S)-2-[3,4-bis(1H-indol-3-yl)-2,5-dioxopyrrol-1-yl]-3-phenylpropanoate | 1227698-77-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: methyl (2S)-2-[3,4-bis(1H-indol-3-yl)-2,5-dioxopyrrol-1-yl]-3-phenylpropanoate
• CAS: 1227698-77-2
• 化学式: C₃₀H₂₃N₃O₄
• 分子量: 489.53
• InChiKey: MWDPMWSSHHILFS-VWLOTQADSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  37
• 可旋转键数：
  7
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  95.3
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  L-苯丙氨酸甲酯 、 2,3-bis(1H-indol-3-yl)maleic anhydride 以 甲苯 为溶剂， 反应 12.0h， 生成 methyl (2S)-2-[3,4-bis(1H-indol-3-yl)-2,5-dioxopyrrol-1-yl]-3-phenylpropanoate
  参考文献：
  名称：

  Synthesis and antitumor activity of bisindolylmaleimide and amino acid ester conjugates

  摘要：

  A series of novel bisindolylmaleimide and natural amino acid ester conjugates were synthesized and evaluated for their inhibitory activity against six tumor cell lines. Some compounds displayed interesting cytotoxic profiles. The most active compound 8e showed inhibitory activity against several human cancer cell lines.

  DOI：

  10.1080/10286020903413385

文献信息

• Synthesis and antitumor activity of bisindolylmaleimide and amino acid ester conjugates
  作者：Ke Wang、Xiang-Yan Li、Xiao-Guang Chen、Zhan-Zhu Liu

  DOI：10.1080/10286020903413385

  日期：2010.1.1

  A series of novel bisindolylmaleimide and natural amino acid ester conjugates were synthesized and evaluated for their inhibitory activity against six tumor cell lines. Some compounds displayed interesting cytotoxic profiles. The most active compound 8e showed inhibitory activity against several human cancer cell lines.