5-amino-2-phenyl-<1,2,4>triazolo<1,5-a><1,3,5>triazine | 28610-03-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 5-amino-2-phenyl-<1,2,4>triazolo<1,5-a><1,3,5>triazine
• 英文别名: 7-amino-2-phenyl-1,2,4-triazolo[1,5-a][1,3,5]triazine；2-phenyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-ylamine；Triazolo-triazin IVe；2-Phenyl[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-ylamine；2-phenyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
• CAS: 28610-03-9
• 化学式: C₁₀H₈N₆
• mdl: MFCD10476964
• 分子量: 212.214
• InChiKey: IDMHZGHZDUCXCL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  82
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  3-氨基-5-苯基-1,2,4-三唑 在 sodium 作用下， 以 甲醇 、 甲苯 为溶剂， 反应 25.5h， 生成 5-amino-2-phenyl-<1,2,4>triazolo<1,5-a><1,3,5>triazine
  参考文献：
  名称：

  A New Synthesis of Amino Substituted Azolo[1,3,5]triazines via Reaction of N1,N1-Dimethyl-N2-azolylformamidines with Cyanamide

  摘要：

  The amino substituted triazine ring was annelated to aminoazoles using a new effective synthetic procedure. The method of preparation involved initial formation of azolylformamidines in the reaction of aminoazoles with N,N-dimethylformamide dimethyl acetal followed by the triazine ring closure with cyanamide affording therefore fused aminotriazines.

  DOI：

  10.3987/com-12-12601

文献信息

• A novel multicomponent microwave-assisted synthesis of 5-aza-adenines
  作者：Anton V. Dolzhenko、Svetlana A. Kalinina、Dmitrii V. Kalinin

  DOI：10.1039/c3ra41932k

  日期：——

  A novel multicomponent strategy for the efficient synthesis of 5-aza-adenines was developed. 5-Aza-adenines were prepared in a one-pot fashion from 5-amino-1,2,4-triazoles, cyanamide and triethyl orthoformate under microwave irradiation. The operational simplicity, efficiency and accessibility of this method make it highly attractive for the generation of bioactive compound libraries.

  开发了一种新型多组分策略，用于高效合成5-偶氮腺嘌呤。通过微波照射下，以5-氨基-1,2,4-三氮唑、氰脲酰胺和三乙基原甲酸酯在单一容器中制备了5-偶氮腺嘌呤。该方法操作简便、高效且易于实施，使其在生成生物活性化合物库方面极具吸引力。
• Miyamoto, Yoshiko; Yamazaki, Chiji; Matzui, Megumi, Journal of Heterocyclic Chemistry, 1990, vol. 27, # 6, p. 1553 - 1557
  作者：Miyamoto, Yoshiko、Yamazaki, Chiji、Matzui, Megumi

  DOI：——

  日期：——
• Lalezari, I.; Nabahi, S., Journal of Heterocyclic Chemistry, 1980, vol. 17, p. 1121 - 1123
  作者：Lalezari, I.、Nabahi, S.

  DOI：——

  日期：——
• LALEZARI I.; NABAHI S., J. HETEROCYCL. CHEM., 1980, 17, NO 5, 1121-1123
  作者：LALEZARI I.、 NABAHI S.

  DOI：——

  日期：——
• A New Synthesis of Amino Substituted Azolo[1,3,5]triazines via Reaction of N1,N1-Dimethyl-N2-azolylformamidines with Cyanamide
  作者：Anton V. Dolzhenko、Dmitrii V. Kalinin、Svetlana A. Kalinina

  DOI：10.3987/com-12-12601

  日期：——

  The amino substituted triazine ring was annelated to aminoazoles using a new effective synthetic procedure. The method of preparation involved initial formation of azolylformamidines in the reaction of aminoazoles with N,N-dimethylformamide dimethyl acetal followed by the triazine ring closure with cyanamide affording therefore fused aminotriazines.