2-(4-溴苯基)嘧啶-4-醇 | 88627-12-7

• 物质功能分类: 医药中间体 - 杂环化合物 - 嘧啶类化合物
• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 中文名称: 2-(4-溴苯基)嘧啶-4-醇
• 英文名称: 2-(4-bromophenyl)-pyrimidin-4-one
• 英文别名: 2-(4-Bromophenyl)pyrimidin-4(3H)-one；2-(4-bromophenyl)-1H-pyrimidin-6-one
• CAS: 88627-12-7
• 化学式: C₁₀H₇BrN₂O
• 分子量: 251.082
• InChiKey: OXXPMLSACQYOPI-UHFFFAOYSA-N

物化性质

• 熔点：
  247-249 °C
• 密度：
  1.61±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  41.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(4-溴苯基)嘧啶-4-醇 在 三氯氧磷 作用下， 反应 4.0h， 以69%的产率得到2-(p-bromophenyl)-4-chloropyrimidine
  参考文献：
  名称：

  Reaction of aryl-substituted azidopyrimidines with 1,3-dicarbonyl compounds

  摘要：

  DOI：

  10.1007/bf00505770
• 作为产物：
  描述：

  4-溴苯甲脒盐酸盐水合物 在 potassium hydroxide 、 sodium hydroxide 作用下， 以 乙醇 、 水 为溶剂， 生成 2-(4-溴苯基)嘧啶-4-醇
  参考文献：
  名称：

  Synthesis and structure–activity relationship of 4-amino-2-phenylpyrimidine derivatives as a series of novel GPR119 agonists

  摘要：

  Through preparation and examination of a series of novel 4-amino-2-phenylpyrimidine derivatives as agonists for GPR119, we identified 2-(4-bromophenyl)-6-methyl-N-[2-(1-oxidopyridin-3-yl)ethyl]pyrimidin-4-amine (9t). Compound 9t improved glucose tolerance in mice following oral administration and showed good pharmacokinetic profiles in rats. Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmc.2012.02.006

文献信息

• Reaction of aryl-substituted azidopyrimidines with 1,3-dicarbonyl compounds
  作者：V. P. Krivopalov、E. B. Nikolaenkova、V. F. Sedova、V. P. Mamaev

  DOI：10.1007/bf00505770

  日期：1983.10
• KRIVOPALOV, V. P.;NIKOLAENKOVA, E. B.;SEDOVA, V. F.;MAMAEV, V. P., XIMIYA GETEROTSIKL. SOEDIN., 1983, N 10, 1401-1405
  作者：KRIVOPALOV, V. P.、NIKOLAENKOVA, E. B.、SEDOVA, V. F.、MAMAEV, V. P.

  DOI：——

  日期：——
• TUBULIN POLYMERIZATION INHIBITORS
  申请人：[en]AB SCIENCE

  公开号：WO2024146923A1

  公开（公告）日：2024-07-11

  The present invention relates to a compound of formula (I) or a pharmaceutically acceptable salt and/or solvate thereof, wherein B is an aryl or a five- or six-membered heteroaryl, and R1-R5, V, W, Y and Z may be various groups. The compounds according to the invention are useful as tubulin polymerization inhibitors, in particular for use in the treatment of hematological disorders and/or proliferative disorders.
• Synthesis and structure–activity relationship of 4-amino-2-phenylpyrimidine derivatives as a series of novel GPR119 agonists
  作者：Kenji Negoro、Yasuhiro Yonetoku、Tatsuya Maruyama、Shigeru Yoshida、Makoto Takeuchi、Mitsuaki Ohta

  DOI：10.1016/j.bmc.2012.02.006

  日期：2012.4

  Through preparation and examination of a series of novel 4-amino-2-phenylpyrimidine derivatives as agonists for GPR119, we identified 2-(4-bromophenyl)-6-methyl-N-[2-(1-oxidopyridin-3-yl)ethyl]pyrimidin-4-amine (9t). Compound 9t improved glucose tolerance in mice following oral administration and showed good pharmacokinetic profiles in rats. Published by Elsevier Ltd.