6-phenyl-3-methyl-1,4,6,7-tetrahydropyrazolo[4,3-b]pyridin-5-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 6-phenyl-3-methyl-1,4,6,7-tetrahydropyrazolo[4,3-b]pyridin-5-one
• 英文别名: 3-Methyl-6-phenyl-2,4,6,7-tetrahydropyrazolo[4,3-b]pyridin-5-one；3-methyl-6-phenyl-2,4,6,7-tetrahydropyrazolo[4,3-b]pyridin-5-one
• 化学式: C₁₃H₁₃N₃O
• 分子量: 227.266
• InChiKey: BOMPRKYPZJSTKA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  57.8
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  3-(5-methyl-4-nitro-2H-pyrazol-3-yl)-2-phenylpropionic acid 在 盐酸 、 tin(ll) chloride 作用下， 以 四氢呋喃 为溶剂， 反应 16.0h， 以81%的产率得到6-phenyl-3-methyl-1,4,6,7-tetrahydropyrazolo[4,3-b]pyridin-5-one
  参考文献：
  名称：

  Modular synthesis of isoxazolopyridones and pyrazolopyridones

  摘要：

  Herein we described the preparation of two novel heterocyclic nuclei isoxazolopyridone and pyrazolopyridone. The syntheses are modular in nature and fast to execute. The title compounds were obtained pure without intervention of chromatography. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2006.12.044

文献信息

• Modular synthesis of isoxazolopyridones and pyrazolopyridones
  作者：Mauro F.A. Adamo、Eleanor F. Duffy、Donato Donati、Piero Sarti-Fantoni

  DOI：10.1016/j.tet.2006.12.044

  日期：2007.2

  Herein we described the preparation of two novel heterocyclic nuclei isoxazolopyridone and pyrazolopyridone. The syntheses are modular in nature and fast to execute. The title compounds were obtained pure without intervention of chromatography. (c) 2007 Elsevier Ltd. All rights reserved.