| 1370029-78-9

• 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
• CAS: 1370029-78-9
• 化学式: C₂₃H₂₀N₄O₂
• 分子量: 384.437
• InChiKey: ODKXUSRZGJLEGH-UHFFFAOYSA-N

物化性质

• 沸点：
  678.4±55.0 °C(Predicted)
• 密度：
  1.38±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.99
• 重原子数：
  29.0
• 可旋转键数：
  4.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  84.12
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  在 4-二甲氨基吡啶 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 、 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 2.0h， 生成 (S)-N-(2-(3-(4-(1H-indol-3-yl)-1-methyl-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl)-1H-indol-1-yl)ethyl)-2-amino-4-methylpentanamide
  参考文献：
  名称：

  Synthesis and cytotoxic activities of a series of novel N-methylbisindolylmaleimide amino acid ester conjugates

  摘要：

  A series of novel N-methylbisindolylmaleimides and natural amino acid conjugates were synthesized and evaluated for their inhibitory activity against six tumor cell lines. Most of the compounds exhibited moderate in vitro cytotoxic activities in the range of 10-100 mu mol/L. (C) 2012 Zhan Zhu Liu. Published by Elsevier B.V. on behalf of Chinese Chemical Society. All rights reserved.

  DOI：

  10.1016/j.cclet.2012.01.033
• 作为产物：
  描述：

  2,3-二溴-N-甲基马来酰亚胺 在 sodium hydride 、 lithium hexamethyldisilazane 作用下， 以 N,N-二甲基甲酰胺 、 甲苯 为溶剂， 生成
  参考文献：
  名称：

  Synthesis and cytotoxic activities of a series of novel N-methylbisindolylmaleimide amino acid ester conjugates

  摘要：

  A series of novel N-methylbisindolylmaleimides and natural amino acid conjugates were synthesized and evaluated for their inhibitory activity against six tumor cell lines. Most of the compounds exhibited moderate in vitro cytotoxic activities in the range of 10-100 mu mol/L. (C) 2012 Zhan Zhu Liu. Published by Elsevier B.V. on behalf of Chinese Chemical Society. All rights reserved.

  DOI：

  10.1016/j.cclet.2012.01.033

文献信息

• Synthesis and cytotoxic activities of a series of novel<i>N</i>-methyl-bisindolylmaleimide amide derivatives
  作者：Ke Wang、Zhan-Zhu Liu

  DOI：10.1080/10286020.2013.877452

  日期：2014.3.4

  A novel series of N-methyl-bisindolylmaleimides were synthesized and evaluated for their inhibitory activities against nine tumor cell lines. Some of the compounds showed an interesting activity against the tested cell lines. The most potent compounds 5e and 5j displayed antiproliferative activity with 50% inhibitory concentration values in the M range against some tested cell lines.