6-[3-(dimethylamino)propylamino]-3-methyl-1H-pyrimidine-2,4-dione | 1228356-21-5

• 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: 6-[3-(dimethylamino)propylamino]-3-methyl-1H-pyrimidine-2,4-dione
• CAS: 1228356-21-5
• 化学式: C₁₀H₁₈N₄O₂
• 分子量: 226.279
• InChiKey: JBNZGXJLOIUTNJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.2
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  64.7
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6-[3-(dimethylamino)propylamino]-3-methyl-1H-pyrimidine-2,4-dione 在 溶剂黄146 、 sodium nitrite 作用下， 以 水 为溶剂， 生成 6-[3-(dimethylamino)propylamino]-3-methyl-5-nitroso-1H-pyrimidine-2,4-dione
  参考文献：
  名称：

  Synthesis of Novel 3,7-Dihydro-purine-2,6-dione Derivatives

  摘要：

  Forty-six novel 3,7-dihydro-purine-2,6-dione derivatives (substituted xanthines) with great structural diversity were synthesized for biological activity screening. Three series of substituted xanthine analogs have been prepared in moderate to excellent yields.

  DOI：

  10.1080/00397910903097260
• 作为产物：
  描述：

  6-氯-3-甲基尿嘧啶 、 N,N-二甲基-1,3-二氨基丙烷 以 乙醇 为溶剂， 生成 6-[3-(dimethylamino)propylamino]-3-methyl-1H-pyrimidine-2,4-dione
  参考文献：
  名称：

  Synthesis of Novel 3,7-Dihydro-purine-2,6-dione Derivatives

  摘要：

  Forty-six novel 3,7-dihydro-purine-2,6-dione derivatives (substituted xanthines) with great structural diversity were synthesized for biological activity screening. Three series of substituted xanthine analogs have been prepared in moderate to excellent yields.

  DOI：

  10.1080/00397910903097260