5-amino-4-<3-(dimethylamino)acryloyl>-2-methyl-1,2,3-triazole | 129959-38-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 5-amino-4-<3-(dimethylamino)acryloyl>-2-methyl-1,2,3-triazole
• CAS: 129959-38-2
• 化学式: C₈H₁₃N₅O
• 分子量: 195.224
• InChiKey: MNBRYLQWVPYXCB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.34
• 重原子数：
  14.0
• 可旋转键数：
  3.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  77.04
• 氢给体数：
  1.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  5-amino-4-<3-(dimethylamino)acryloyl>-2-methyl-1,2,3-triazole 以 正丁醇 为溶剂， 反应 4.0h， 生成 2-甲基-2,3-二氢-7H-[1,2,3]三唑并[4,5-b]吡啶-7-酮
  参考文献：
  名称：

  Synthesis of derivatives of 5-amino-4-acyl-1,2,3-triazole, 8-azapurine, and 1,2,3-triazolo[4,5-b]pyridin-7-one using N,N-acetals of acylketenes and tosylazide

  摘要：

  By reaction of N,N-acetals of acylketenes with tosylazide there were synthesized 5-amino-4-acyl-1,2,3-triazoles substituted at the endo(N1)- or exocyclic nitrogen atom. Triazoles containing a free NH2 group were used in the synthesis of the corresponding 8-azapurines and 4-acetyl-5-benzoylamino-1,2,3-triazole afforded 2-methyl-2H,4H-1,2,3-triazolo[4,5-b]pyridin-7-one.

  DOI：

  10.1007/bf00962394
• 作为产物：
  描述：

  5-benzoylamino-4-<3-(dimethylamino)acryloyl>-2-methyl-1,2,3-triazole 在 sodium methylate 作用下， 以 甲醇 为溶剂， 反应 12.0h， 以83%的产率得到5-amino-4-<3-(dimethylamino)acryloyl>-2-methyl-1,2,3-triazole
  参考文献：
  名称：

  Synthesis of derivatives of 5-amino-4-acyl-1,2,3-triazole, 8-azapurine, and 1,2,3-triazolo[4,5-b]pyridin-7-one using N,N-acetals of acylketenes and tosylazide

  摘要：

  By reaction of N,N-acetals of acylketenes with tosylazide there were synthesized 5-amino-4-acyl-1,2,3-triazoles substituted at the endo(N1)- or exocyclic nitrogen atom. Triazoles containing a free NH2 group were used in the synthesis of the corresponding 8-azapurines and 4-acetyl-5-benzoylamino-1,2,3-triazole afforded 2-methyl-2H,4H-1,2,3-triazolo[4,5-b]pyridin-7-one.

  DOI：

  10.1007/bf00962394

文献信息

• Synthesis of derivatives of 5-amino-4-acyl-1,2,3-triazole, 8-azapurine, and 1,2,3-triazolo[4,5-b]pyridin-7-one using N,N-acetals of acylketenes and tosylazide
  作者：M. F. Gordeev、A. V. Komkov、V. S. Bogdanov、V. A. Dorokhov

  DOI：10.1007/bf00962394

  日期：1990.6

  By reaction of N,N-acetals of acylketenes with tosylazide there were synthesized 5-amino-4-acyl-1,2,3-triazoles substituted at the endo(N1)- or exocyclic nitrogen atom. Triazoles containing a free NH2 group were used in the synthesis of the corresponding 8-azapurines and 4-acetyl-5-benzoylamino-1,2,3-triazole afforded 2-methyl-2H,4H-1,2,3-triazolo[4,5-b]pyridin-7-one.