3-(6-((4S)-6-azaspiro[2.5]oct-4-yloxy)-2-pyrazinyl)-5-(2,6-difluorophenyl)-1H-indazole | 1380916-12-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-(6-((4S)-6-azaspiro[2.5]oct-4-yloxy)-2-pyrazinyl)-5-(2,6-difluorophenyl)-1H-indazole
• 英文别名: 3-[6-[[(8S)-6-azaspiro[2.5]octan-8-yl]oxy]pyrazin-2-yl]-5-(2,6-difluorophenyl)-1H-indazole
• CAS: 1380916-12-0
• 化学式: C₂₄H₂₁F₂N₅O
• 分子量: 433.46
• InChiKey: FCGLYPSBPNFQRF-HXUWFJFHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  32
• 可旋转键数：
  4
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  75.7
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  3-(6-(6-azaspiro[2.5]octan-4-yloxy)pyrazin-2-yl)-5-(2,6-difluorophenyl)-1H-indazole 生成 3-(6-((4S)-6-azaspiro[2.5]oct-4-yloxy)-2-pyrazinyl)-5-(2,6-difluorophenyl)-1H-indazole 、 (R)-3-(6-(6-azaspiro[2.5]octan-4-yloxy)pyrazin-2-yl)-5-(2,6-difluorophenyl)-1H-indazole
  参考文献：
  名称：

  The discovery of novel 3-(pyrazin-2-yl)-1H-indazoles as potent pan-Pim kinase inhibitors

  摘要：

  The three Pim kinases are a small family of serine/threonine kinases regulating several signaling pathways that are fundamental to tumorigenesis. As such, the Pim kinases are a very attractive target for pharmacological inhibition in cancer therapy. Herein, we describe our efforts toward the development of a potent, pan-Pim inhibitor. The synthesis and hit-to-lead SAR development from a 3-(pyrazin-2-yl)-1H-indazole derived hit 2 to the identification of a series of potent, pan-Pim inhibitors such as 13o are described. Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2014.12.068