4-(1H-pyrrolo[2,3-b]pyridin-5-ylethynyl)aniline | 1174296-38-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯并吡啶类
• 英文名称: 4-(1H-pyrrolo[2,3-b]pyridin-5-ylethynyl)aniline
• 英文别名: 4-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethynyl]aniline
• CAS: 1174296-38-8
• 化学式: C₁₅H₁₁N₃
• 分子量: 233.272
• InChiKey: HOGUOHDHLRNGHU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  54.7
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  4-乙炔基苯胺 、 5-溴-7-氮杂吲哚 在 copper(l) iodide 、 二(氰基苯)二氯化钯 、 2-二-叔丁膦基-2',4',6'-三异丙基联苯 哌啶 作用下， 以 1,4-二氧六环 为溶剂， 以25%的产率得到4-(1H-pyrrolo[2,3-b]pyridin-5-ylethynyl)aniline
  参考文献：
  名称：

  PROTEIN KINASE INHIBITORS AND USE THEREOF

  摘要：

  根据以下公式I披露了化合物：其中变量如本文所述。

  公开号：

  US20110282056A1

文献信息

• [EN] PROTEIN KINASE INHIBITORS AND USE THEREOF<br/>[FR] INHIBITEURS DE PROTÉINE KINASE ET LEUR UTILISATION
  申请人：MERCK SERONO SA

  公开号：WO2009094123A1

  公开（公告）日：2009-07-30

  Disclosed are compounds according to Formula I: wherein: W1 is CR8 or N, and W2 is -C-C=C-Ar; or W1 is -C-C≡C-Ar, and W2 is CR8 or N; Y is _s., -O-, -NH-, or -NHCH2-; X is N or N+-O';One aspect of the present invention is to provide novel compounds according to Formula l that are useful in the treatment of hyperproliferative diseases and inflammatory diseases. Specifically, the compounds of the invention are protein kinase inhibitors. As a result, this invention provides in a first aspect novel compounds according to Formula I, as well as pharmaceutically acceptable salts and pharmaceutically active derivatives thereof, that are useful for the treatment of a subject in need of inhibition of a protein kinase. Values and particular values for the variables in Formula I are provided in the following paragraphs.
• PROTEIN KINASE INHIBITORS AND USE THEREOF
  申请人：Askew Benny C.

  公开号：US20110282056A1

  公开（公告）日：2011-11-17

  Disclosed are compounds according to Formula I: wherein the variables are described herein.

  根据以下公式I披露了化合物：其中变量如本文所述。