N-(5-chloro-4-fluoropyrimidin-2-yl)-4-phenyl-1H-pyrrole-3-carboxamide | 1543022-71-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: N-(5-chloro-4-fluoropyrimidin-2-yl)-4-phenyl-1H-pyrrole-3-carboxamide
• 英文别名: N-(5-chloro-4-fluoropyrimidin-2-yl)-4-phenyl-1h-pyrrole-3-carboxamide
• CAS: 1543022-71-4
• 化学式: C₁₅H₁₀ClFN₄O
• 分子量: 316.722
• InChiKey: AYQPBXIULAFUJH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  70.7
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  肉桂酸乙酯 在 Methanaminium,N-[(dimethylamino)(3H-1,2,3-triazolo[4,5-b]pyridin-3-yloxy)methylene]-N-methyl-, hexafluorophosphate(1-) 、 sodium hydroxide 作用下， 以 四氢呋喃 、 乙醚 、 二甲基亚砜 、 N,N-二甲基甲酰胺 为溶剂， 反应 0.5h， 生成 N-(5-chloro-4-fluoropyrimidin-2-yl)-4-phenyl-1H-pyrrole-3-carboxamide
  参考文献：
  名称：

  Synthesis and antimicrobial activity of some new amido/sulfonamido-linked 3,4-disubstituted pyrroles

  摘要：

  A new series of pyrrolyl carboxamides, pyrrolyl sulfonamides, and pyrrolyl pyrimidine derivatives were prepared from simple starting compounds-ethyl 3-phenylacrylate and ethyl 3-furanylacrylate under ultrasonication and screened for their antimicrobial activity. Among the tested compounds pyrrolyl pyrimidine derivatives and chloro-substituted pyrroles displayed excellent activity when compared to the other compounds. The chloro-substituted pyrrolyl sulfonamides are the potent antimicrobial agents particularly against P. aeruginosa and P. chrysogenum.

  DOI：

  10.1007/s00044-014-0908-1

文献信息

• Synthesis and antimicrobial activity of some new amido/sulfonamido-linked 3,4-disubstituted pyrroles
  作者：Kaveri Syamaiah、Guda Mallikarjuna Reddy、Venkatapuram Padmavathi、Adivireddy Padmaja

  DOI：10.1007/s00044-014-0908-1

  日期：2014.7

  A new series of pyrrolyl carboxamides, pyrrolyl sulfonamides, and pyrrolyl pyrimidine derivatives were prepared from simple starting compounds-ethyl 3-phenylacrylate and ethyl 3-furanylacrylate under ultrasonication and screened for their antimicrobial activity. Among the tested compounds pyrrolyl pyrimidine derivatives and chloro-substituted pyrroles displayed excellent activity when compared to the other compounds. The chloro-substituted pyrrolyl sulfonamides are the potent antimicrobial agents particularly against P. aeruginosa and P. chrysogenum.