3-N-(3-methoxyphenyl)-5-phenyl-1,2,4-triazole-3,4-diamine | 182260-86-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-N-(3-methoxyphenyl)-5-phenyl-1,2,4-triazole-3,4-diamine
• CAS: 182260-86-2
• 化学式: C₁₅H₁₅N₅O
• 分子量: 281.317
• InChiKey: IFBZKEMFBZAOOW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  78
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  草酰氯 、 3-N-(3-methoxyphenyl)-5-phenyl-1,2,4-triazole-3,4-diamine 在 三乙胺 作用下， 以 苯 为溶剂， 反应 4.0h， 以70%的产率得到8-(3-methoxyphenyl)-3-phenyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazine-6,7-dione
  参考文献：
  名称：

  Synthetic Studies on the Reactions of Hydrazine and Aroylhydrazide with 5-Phenyl-1,3,4-Oxadiazol-2-thione

  摘要：

  The reacton of 5-phenyl-1,3,4-oxadiazol-2-thione 1 with hydrazine hydrate in refluxing n-butanol afforded benzoylcarbohydrazide 2 which was cyclized to 4-amino-3-chloro-5-phenyl-1,2,4-triazole 3. Compound 3 was used for the synthesis of some new di-or polyheterocyclic derivatives via its reaction with anilines and treating the products with bidentates.

  DOI：

  10.1080/00397919608003799
• 作为产物：
  描述：

  benzoyl carbohydrazide 在 三乙胺 、 三氯氧磷 作用下， 以 乙醇 为溶剂， 反应 10.0h， 生成 3-N-(3-methoxyphenyl)-5-phenyl-1,2,4-triazole-3,4-diamine
  参考文献：
  名称：

  Synthetic Studies on the Reactions of Hydrazine and Aroylhydrazide with 5-Phenyl-1,3,4-Oxadiazol-2-thione

  摘要：

  The reacton of 5-phenyl-1,3,4-oxadiazol-2-thione 1 with hydrazine hydrate in refluxing n-butanol afforded benzoylcarbohydrazide 2 which was cyclized to 4-amino-3-chloro-5-phenyl-1,2,4-triazole 3. Compound 3 was used for the synthesis of some new di-or polyheterocyclic derivatives via its reaction with anilines and treating the products with bidentates.

  DOI：

  10.1080/00397919608003799

文献信息

• Synthetic Studies on the Reactions of Hydrazine and Aroylhydrazide with 5-Phenyl-1,3,4-Oxadiazol-2-thione
  作者：G.A. EL-Saraf、A.M. EL-Sayed

  DOI：10.1080/00397919608003799

  日期：1996.10

  The reacton of 5-phenyl-1,3,4-oxadiazol-2-thione 1 with hydrazine hydrate in refluxing n-butanol afforded benzoylcarbohydrazide 2 which was cyclized to 4-amino-3-chloro-5-phenyl-1,2,4-triazole 3. Compound 3 was used for the synthesis of some new di-or polyheterocyclic derivatives via its reaction with anilines and treating the products with bidentates.