10-(2,4-Dimethyl-phenyl)-3-methyl-10H-benzo[g]pteridine-2,4-dione | 117285-04-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 蝶啶及其衍生物
• 英文名称: 10-(2,4-Dimethyl-phenyl)-3-methyl-10H-benzo[g]pteridine-2,4-dione
• 英文别名: Benzo[g]pteridine-2,4(3H,10H)-dione, 10-(2,4-dimethylphenyl)-3-methyl-；10-(2,4-dimethylphenyl)-3-methylbenzo[g]pteridine-2,4-dione
• CAS: 117285-04-8
• 化学式: C₁₉H₁₆N₄O₂
• 分子量: 332.362
• InChiKey: CFNSKGMWEDNPHT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  25
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  65.3
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  6-氯-3-甲基尿嘧啶 在 乙酸酐 、 溶剂黄146 、 N,N-二乙基苯胺 作用下， 反应 1.0h， 生成 10-(2,4-Dimethyl-phenyl)-3-methyl-10H-benzo[g]pteridine-2,4-dione
  参考文献：
  名称：

  Flavins as potential antimalarials. 2. 3-Methyl-10-(substituted-phenyl)flavins

  摘要：

  A series of 3-methyl-10-(substituted-phenyl)flavins was prepared and tested for antimalarial activity against the lethal parasite Plasmodium vinckei in mice. Several of these analogues were found to be effective antimalarial agents. A quantitative structure-activity relationship study was undertaken with 44 analogues and no satisfactory relationship could be established.

  DOI：

  10.1021/jm00110a009

文献信息

• COWDEN, WILLIAM B.;HALLADAY, PETER K.;CUNNINGHAM, ROSS B.;HUNT, NICHOLAS +, J. MED. CHEM., 34,(1991) N, C. 1818-1822
  作者：COWDEN, WILLIAM B.、HALLADAY, PETER K.、CUNNINGHAM, ROSS B.、HUNT, NICHOLAS +

  DOI：——

  日期：——
• Flavins as potential antimalarials. 2. 3-Methyl-10-(substituted-phenyl)flavins
  作者：William B. Cowden、Peter K. Halladay、Ross B. Cunningham、Nicholas H. Hunt、Ian A. Clark

  DOI：10.1021/jm00110a009

  日期：1991.6

  A series of 3-methyl-10-(substituted-phenyl)flavins was prepared and tested for antimalarial activity against the lethal parasite Plasmodium vinckei in mice. Several of these analogues were found to be effective antimalarial agents. A quantitative structure-activity relationship study was undertaken with 44 analogues and no satisfactory relationship could be established.