Pyrrolo-pyrimidone, 5 | 1095858-22-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: Pyrrolo-pyrimidone, 5
• 英文别名: 6-[2-(3-methoxyphenyl)pyridin-4-yl]-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
• CAS: 1095858-22-2
• 化学式: C₁₈H₁₄N₄O₂
• 分子量: 318.335
• InChiKey: GARQBBNLFNDLEJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  24
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  79.4
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  6-(2-chloro-pyridin-4-yl)-3,7-dihydro-pyrrolo[2,3-d]pyrimidin-4-one 、 3-甲氧基苯硼酸频哪醇酯 在 bis-triphenylphosphine-palladium(II) chloride 、 碳酸氢钠 作用下， 以 丙醇 为溶剂， 生成 Pyrrolo-pyrimidone, 5
  参考文献：
  名称：

  Pyrrolo-pyrimidones: A novel class of MK2 inhibitors with potent cellular activity

  摘要：

  Pyrrolo-pyrimidones of the general structure 1 were synthesized and evaluated for their potential as MK2 inhibitors. Potent derivatives were discovered which inhibit MK2 in the nanomolar range and show potent inhibition of cytokine release from LPS-stimulated monocytes. These derivatives were shown to inhibit phosphorylation of hsp27, a downstream target of MK2 and are modestly selective in a panel of 28 kinases. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.10.039

文献信息

• Pyrrolo-pyrimidones: A novel class of MK2 inhibitors with potent cellular activity
  作者：Achim Schlapbach、Roland Feifel、Stuart Hawtin、Richard Heng、Guido Koch、Henrik Moebitz、Laszlo Revesz、Clemens Scheufler、Juraj Velcicky、Rudolf Waelchli、Christine Huppertz

  DOI：10.1016/j.bmcl.2008.10.039

  日期：2008.12

  Pyrrolo-pyrimidones of the general structure 1 were synthesized and evaluated for their potential as MK2 inhibitors. Potent derivatives were discovered which inhibit MK2 in the nanomolar range and show potent inhibition of cytokine release from LPS-stimulated monocytes. These derivatives were shown to inhibit phosphorylation of hsp27, a downstream target of MK2 and are modestly selective in a panel of 28 kinases. (C) 2008 Elsevier Ltd. All rights reserved.