(E)-1-(4-bromobut-2-en-1-yl)-6-fluoro-2-(trifluoromethyl)quinolin-4(1H)-one | 1434574-25-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: (E)-1-(4-bromobut-2-en-1-yl)-6-fluoro-2-(trifluoromethyl)quinolin-4(1H)-one
• 英文别名: 1-[(E)-4-bromobut-2-enyl]-6-fluoro-2-(trifluoromethyl)quinolin-4-one
• CAS: 1434574-25-0
• 化学式: C₁₄H₁₀BrF₄NO
• 分子量: 364.137
• InChiKey: IIZXVOIBLOQANX-OWOJBTEDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  20.3
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N-甲基哌嗪 、 (E)-1-(4-bromobut-2-en-1-yl)-6-fluoro-2-(trifluoromethyl)quinolin-4(1H)-one 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 4.0h， 以68%的产率得到(E)-6-fluoro-1-(4-(4-methylpiperazin-1-yl)but-2-en-1-yl)-2-(trifluoromethyl)quinolin-4(1H)-one
  参考文献：
  名称：

  New trifluoromethyl quinolone derivatives: Synthesis and investigation of antimicrobial properties

  摘要：

  A series of quinolone derivatives, containing different heterocyclic amines were prepared. Synthesized compounds were evaluated for their in vitro antimicrobial activities against two Gram-positive bacteria, three Gram-negative bacteria as well as four fungi. All the derivatives showed good activity towards Gram-positive bacteria and less activity towards Gram-negative bacteria. They also showed moderate to comparable activity against Aspergillus niger and Candida albicans and low to moderate antifungal activity against Aspergillus fumigatus and Aspergillus flavus. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2013.03.120
• 作为产物：
  描述：

  4-氟苯胺 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 6.0h， 生成 (E)-1-(4-bromobut-2-en-1-yl)-6-fluoro-2-(trifluoromethyl)quinolin-4(1H)-one
  参考文献：
  名称：

  New trifluoromethyl quinolone derivatives: Synthesis and investigation of antimicrobial properties

  摘要：

  A series of quinolone derivatives, containing different heterocyclic amines were prepared. Synthesized compounds were evaluated for their in vitro antimicrobial activities against two Gram-positive bacteria, three Gram-negative bacteria as well as four fungi. All the derivatives showed good activity towards Gram-positive bacteria and less activity towards Gram-negative bacteria. They also showed moderate to comparable activity against Aspergillus niger and Candida albicans and low to moderate antifungal activity against Aspergillus fumigatus and Aspergillus flavus. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2013.03.120

文献信息

• New trifluoromethyl quinolone derivatives: Synthesis and investigation of antimicrobial properties
  作者：Siva S. Panda、Subhash C. Jain

  DOI：10.1016/j.bmcl.2013.03.120

  日期：2013.6

  A series of quinolone derivatives, containing different heterocyclic amines were prepared. Synthesized compounds were evaluated for their in vitro antimicrobial activities against two Gram-positive bacteria, three Gram-negative bacteria as well as four fungi. All the derivatives showed good activity towards Gram-positive bacteria and less activity towards Gram-negative bacteria. They also showed moderate to comparable activity against Aspergillus niger and Candida albicans and low to moderate antifungal activity against Aspergillus fumigatus and Aspergillus flavus. (C) 2013 Elsevier Ltd. All rights reserved.