2-(acetylamino)-5-iodo-6-phenyl-4(3H)-pyrimidinone | 102649-68-3

• 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-(acetylamino)-5-iodo-6-phenyl-4(3H)-pyrimidinone
• 英文别名: N-(5-iodo-6-oxo-4-phenyl-1H-pyrimidin-2-yl)acetamide
• CAS: 102649-68-3
• 化学式: C₁₂H₁₀IN₃O₂
• 分子量: 355.135
• InChiKey: IYCPOCSJWVDCSR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  70.6
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-氨基-5-碘-6-苯基-4(1H)-嘧啶酮 、 乙酸酐 反应 2.0h， 以71%的产率得到2-(acetylamino)-5-iodo-6-phenyl-4(3H)-pyrimidinone
  参考文献：
  名称：

  Pyrimidinones. 3. N-Substituted 6-phenylpyrimidinones and pyrimidinediones with diuretic/hypotensive and antiinflammatory activity

  摘要：

  In an extensive analysis of the antiviral and interferon-induction structure-activity relationship of 6-arylpyrimidinones we found that modifications at positions 1-4 of the pyrimidine ring resulted in a loss of activity. However, we uncovered interesting hypotensive and antiinflammatory activity with a series of N-substituted analogues, the results of which we report herein.

  DOI：

  10.1021/jm00158a030

文献信息

• SKULNICK H. I.; LUDENS J. H.; WENDLING M. G.; GLENN E. M.; ROHLOFF N. A.;+, J. MED. CHEM., 29,(1986) N 8, 1499-1504
  作者：SKULNICK H. I.、 LUDENS J. H.、 WENDLING M. G.、 GLENN E. M.、 ROHLOFF N. A.、+

  DOI：——

  日期：——
• Pyrimidinones. 3. N-Substituted 6-phenylpyrimidinones and pyrimidinediones with diuretic/hypotensive and antiinflammatory activity
  作者：Harvey I. Skulnick、James H. Ludens、Michael G. Wendling、E. Myles Glenn、Norman A. Rohloff、Robert J. Smith、Wendell Wierenga

  DOI：10.1021/jm00158a030

  日期：1986.8

  In an extensive analysis of the antiviral and interferon-induction structure-activity relationship of 6-arylpyrimidinones we found that modifications at positions 1-4 of the pyrimidine ring resulted in a loss of activity. However, we uncovered interesting hypotensive and antiinflammatory activity with a series of N-substituted analogues, the results of which we report herein.