N-[5-(2'-nitrophenyl)-1H-1,2,3-triazol-1-yl]isonicotinamide | 1260158-40-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: N-[5-(2'-nitrophenyl)-1H-1,2,3-triazol-1-yl]isonicotinamide
• CAS: 1260158-40-4
• 化学式: C₁₄H₁₀N₆O₃
• 分子量: 310.272
• InChiKey: XNMBULJUFCOCHZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.63
• 重原子数：
  23.0
• 可旋转键数：
  4.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  115.84
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为产物：
  描述：

  异烟肼 、 邻硝基苯甲醛 在 溶剂黄146 作用下， 以 1,4-二氧六环 、 乙醇 为溶剂， 反应 29.0h， 生成 N-[5-(2'-nitrophenyl)-1H-1,2,3-triazol-1-yl]isonicotinamide
  参考文献：
  名称：

  SYNTHESIS AND In vitro ANTIMICROBIAL ACTIVITY OF SOME TRIAZOLE DERIVATIVES

  摘要：

  Some 4-[{1-(substituted)methylidine}-amino]-3-(4-pyridyl)-5-mercapto-4H-1,2,4-triazol (3a- 3f) and N-[5-(4-substituted)-1H-1,2,3-triazol-1-yl]isonicotinamide derivatives (5a- 5e) were synthesized by a sequence of reactions starting from isonicotinic acid hydrazide and is illustrated in scheme 1 and 2. The antibacterial and anti fungal activities of newly synthesized compounds were tested by the disc diffusion method using nutrient agar medium against various microorganisms such as gram positive Staphylococcus aureus and Bacillus subtilis, gram negative Escherichia coli and the fungi Aspergillus niger and Candida albicans. Ciprofloxacin and Fluconazole at 50 mu g/mL were used as standard drugs for antibacterial and antifungal activities, respectively. All the synthesized compounds showed significant activity against various microorganisms.

  DOI：

  10.4067/s0717-97072010000300019