6-{4-[5-(2-bromophenyl)-3-phenyl-1H-pyrazol-1-ylcarbonyl]-5-methyl-1H-1,2,3-triazol-1-yl}-1,3-dimethylpyrimidine-2,4(1H,3H)-dione | 1263152-97-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 6-{4-[5-(2-bromophenyl)-3-phenyl-1H-pyrazol-1-ylcarbonyl]-5-methyl-1H-1,2,3-triazol-1-yl}-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
• 英文别名: 6-{4-[5-(2-Bromophenyl)-3-phenyl-1h-pyrazole-1-carbonyl]-5-methyl-1h-1,2,3-triazol-1-yl}-1,3-di-methylpyrimidine-2,4(1h,3h)-dione；6-[4-[5-(2-bromophenyl)-3-phenylpyrazole-1-carbonyl]-5-methyltriazol-1-yl]-1,3-dimethylpyrimidine-2,4-dione
• CAS: 1263152-97-1
• 化学式: C₂₅H₂₀BrN₇O₃
• 分子量: 546.383
• InChiKey: WIDMZVBZQCIERI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  36
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  106
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  6-azido-1,3-dimethyluracil 在 硫酸 、 sodium ethanolate 、 肼 作用下， 以 吡啶 、 乙醇 为溶剂， 反应 9.0h， 生成 6-{4-[5-(2-bromophenyl)-3-phenyl-1H-pyrazol-1-ylcarbonyl]-5-methyl-1H-1,2,3-triazol-1-yl}-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
  参考文献：
  名称：

  Synthesis and antiviral evaluation of 1,3-dimethyl-6-(1H-1,2,3-triazol-1-YL)pyrimidine-2,4(1H,3H)-dione derivatives

  摘要：

  Some 6-(1H-1,2,3-triazol-1-yl) pyrimidine-2,4(1H,3H)-dione derivatives were synthesized via the reaction of 6-azido-1,3-dimethyluracil with ethyl acetoacetate in the presence of sodium ethoxide. The antiviral activities of these compounds against Hepatitis A virus (HAV, MBB-cell culture adapted strain) and Herpes simples virus type-1 (HSV-1) were tested.

  DOI：

  10.1007/s10593-010-0633-8

文献信息

• Synthesis and antiviral evaluation of 1,3-dimethyl-6-(1H-1,2,3-triazol-1-YL)pyrimidine-2,4(1H,3H)-dione derivatives
  作者：A. Sh. El-Etrawy、A. A.-H. Abdel-Rahman

  DOI：10.1007/s10593-010-0633-8

  日期：2010.12

  Some 6-(1H-1,2,3-triazol-1-yl) pyrimidine-2,4(1H,3H)-dione derivatives were synthesized via the reaction of 6-azido-1,3-dimethyluracil with ethyl acetoacetate in the presence of sodium ethoxide. The antiviral activities of these compounds against Hepatitis A virus (HAV, MBB-cell culture adapted strain) and Herpes simples virus type-1 (HSV-1) were tested.