pyridin-3-yl-[4-(1H-pyrrolo[3,2-b]pyridin-6-yl)piperazin-1-yl]methanone | 1165803-54-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: pyridin-3-yl-[4-(1H-pyrrolo[3,2-b]pyridin-6-yl)piperazin-1-yl]methanone
• CAS: 1165803-54-2
• 化学式: C₁₇H₁₇N₅O
• 分子量: 307.355
• InChiKey: OIPLXSDCQUZGQO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  23
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  65.1
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  pyridin-3-yl-[4-(1H-pyrrolo[3,2-b]pyridin-6-yl)piperazin-1-yl]methanone 、 2,1,3-苯并二唑-4-磺酰氯 在 三乙胺 作用下， 以 四氢呋喃 为溶剂， 生成 (4-(1-(benzo[c][1,2,5]oxadiazol-4-ylsulfonyl)-1H-pyrrolo[3,2-b]pyridin-6-yl)piperazin-1-yl)(pyridin-3-yl)methanone
  参考文献：
  名称：

  Discovery of 4-azaindoles as novel inhibitors of c-Met kinase

  摘要：

  A series of 4-azaindole inhibitors of c-Met kinase is described. The postulated binding mode was confirmed by an X-ray crystal structure and series optimisation was performed on the basis of this structure. Future directions for series development are discussed.

  DOI：

  10.1016/j.bmcl.2009.03.110

文献信息

• Discovery of 4-azaindoles as novel inhibitors of c-Met kinase
  作者：John Porter、Simon Lumb、Richard J. Franklin、Jose M. Gascon-Simorte、Mark Calmiano、Kelly Le Riche、Bénédicte Lallemand、Jean Keyaerts、Helen Edwards、Alison Maloney、Jean Delgado、Lloyd King、Anne Foley、Fabien Lecomte、James Reuberson、Christoph Meier、Mark Batchelor

  DOI：10.1016/j.bmcl.2009.03.110

  日期：2009.5

  A series of 4-azaindole inhibitors of c-Met kinase is described. The postulated binding mode was confirmed by an X-ray crystal structure and series optimisation was performed on the basis of this structure. Future directions for series development are discussed.