2-benzyl-6-(4-pyridyl)pyrimidin-4-one

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 2-benzyl-6-(4-pyridyl)pyrimidin-4-one
• 英文别名: 2-benzyl-4-pyridin-4-yl-1H-pyrimidin-6-one
• 化学式: C₁₆H₁₃N₃O
• 分子量: 263.299
• InChiKey: XJGHOMYSFWXDDP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  54.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  异烟酰乙酸乙酯 、 苯乙脒 在 potassium carbonate 作用下， 以 乙醇 为溶剂， 生成 2-benzyl-6-(4-pyridyl)pyrimidin-4-one
  参考文献：
  名称：

  6-(4-Pyridyl)pyrimidin-4(3H)-ones as CNS penetrant glycogen synthase kinase-3β inhibitors

  摘要：

  The discovery of a series of 6-(4-pyridyl)pyrimidin-4(3H)-ones derived from a hit compound with low molecular weight and sufficient chemical space is reported. Transformation of substituents led to subnanomolar potent inhibitors with in vivo tau phoshorylation lowering activity. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2013.09.021

文献信息

• PYRIMIDONE DERIVATIVES
  申请人：MITSUBISHI CHEMICAL CORPORATION

  公开号：EP1115721B1

  公开（公告）日：2003-12-10
• US7256199B1
  申请人：——

  公开号：US7256199B1

  公开（公告）日：2007-08-14
• [EN] PYRIMIDONE DERIVATIVES<br/>[FR] DERIVES PYRIMIDONE
  申请人：MITSUBISHI CHEM CORP

  公开号：WO2000018758A1

  公开（公告）日：2000-04-06

  A pyrimidone derivative represented by formula (I) or a salts thereof: wherein R1 represents an alkyl group, an alkenyl group, an alkynyl group, a cycloalkyl group, an aryl group and the like; R2 represents a hydrogen atom, hydroxyl group, an alkyl group, an alkenyl group and the like, R3 represents a pyridyl group, and a medicament comprising said derivative or a salt thereof as an active ingredient which is used for preventive and/or therapeutic treatment of a disease caused by tau protein kinase l hyperactivity such as Alzheimer disease.
• 6-(4-Pyridyl)pyrimidin-4(3H)-ones as CNS penetrant glycogen synthase kinase-3β inhibitors
  作者：Fumiaki Uehara、Aya Shoda、Keiichi Aritomo、Kenji Fukunaga、Kazutoshi Watanabe、Ryoichi Ando、Masaki Shinoda、Hiroaki Ueno、Hideo Kubodera、Shinji Sunada、Ken-Ichi Saito、Takahide Kaji、Shoichi Asano、Jun-ichi Eguchi、Satoshi Yuki、Shinji Tanaka、Yukimi Yoneyama、Takuro Niwa

  DOI：10.1016/j.bmcl.2013.09.021

  日期：2013.12

  The discovery of a series of 6-(4-pyridyl)pyrimidin-4(3H)-ones derived from a hit compound with low molecular weight and sufficient chemical space is reported. Transformation of substituents led to subnanomolar potent inhibitors with in vivo tau phoshorylation lowering activity. (C) 2013 Elsevier Ltd. All rights reserved.