N'-(4-aminophenylsulfonyl)pyrimidine-2-carboximidamide | 1254362-44-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N'-(4-aminophenylsulfonyl)pyrimidine-2-carboximidamide
• 英文别名: N'-(4-aminophenyl)sulfonylpyrimidine-2-carboximidamide
• CAS: 1254362-44-1
• 化学式: C₁₁H₁₁N₅O₂S
• 分子量: 277.307
• InChiKey: OJIYHGOTAZVGEJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.1
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  133
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N'-(4-aminophenylsulfonyl)pyrimidine-2-carboximidamide 、 乙酸酐 在 吡啶 作用下， 反应 0.5h， 以84%的产率得到N'-[4-[N-[amino(pyrimidin-2-yl)methylene]sulfamoyl]phenyl]acetamide
  参考文献：
  名称：

  Synthesis, structure, and antimicrobial activity of heterocyclic phenylsulfonyl- and 4-aminophenylsulfonyl-carboximidamides

  摘要：

  A series of novel phenylsulfonyl- and 4-aminophenylsulfonyl-carboximidamides were synthesized by condensation of sulfonamides with heterocyclic methyl carbimidates obtained from heterocyclic carbonitriles and used 'at its inception.' The molecular structure of the obtained compounds is discussed. Compounds possessing heterocyclic systems with a nitrogen atom in the alpha position to the functional group showed a different single-crystal structure than expected. The synthesized derivatives were evaluated for antimicrobial activities: tuberculostatic, antibacterial, and antifungal..

  DOI：

  10.1007/s00706-012-0769-6
• 作为产物：
  描述：

  2-氰基嘧啶 在 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 甲醇 为溶剂， 反应 3.5h， 生成 N'-(4-aminophenylsulfonyl)pyrimidine-2-carboximidamide
  参考文献：
  名称：

  Synthesis, structure, and antimicrobial activity of heterocyclic phenylsulfonyl- and 4-aminophenylsulfonyl-carboximidamides

  摘要：

  A series of novel phenylsulfonyl- and 4-aminophenylsulfonyl-carboximidamides were synthesized by condensation of sulfonamides with heterocyclic methyl carbimidates obtained from heterocyclic carbonitriles and used 'at its inception.' The molecular structure of the obtained compounds is discussed. Compounds possessing heterocyclic systems with a nitrogen atom in the alpha position to the functional group showed a different single-crystal structure than expected. The synthesized derivatives were evaluated for antimicrobial activities: tuberculostatic, antibacterial, and antifungal..

  DOI：

  10.1007/s00706-012-0769-6

文献信息

• Synthesis, structure, and antimicrobial activity of heterocyclic phenylsulfonyl- and 4-aminophenylsulfonyl-carboximidamides
  作者：Katarzyna Gobis、Henryk Foks、Katarzyna Wiśniewska、Maria Dąbrowska-Szponar、Ewa Augustynowicz-Kopeć、Agnieszka Napiórkowska、Artur Sikorski

  DOI：10.1007/s00706-012-0769-6

  日期：2012.8

  A series of novel phenylsulfonyl- and 4-aminophenylsulfonyl-carboximidamides were synthesized by condensation of sulfonamides with heterocyclic methyl carbimidates obtained from heterocyclic carbonitriles and used 'at its inception.' The molecular structure of the obtained compounds is discussed. Compounds possessing heterocyclic systems with a nitrogen atom in the alpha position to the functional group showed a different single-crystal structure than expected. The synthesized derivatives were evaluated for antimicrobial activities: tuberculostatic, antibacterial, and antifungal..