ethyl 2-(6,7-difluoro-3-oxo-4H-quinoxalin-2-yl)acetate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: ethyl 2-(6,7-difluoro-3-oxo-4H-quinoxalin-2-yl)acetate
• 化学式: C₁₂H₁₀F₂N₂O₃
• 分子量: 268.22
• InChiKey: VLQFUYIXRPAFAI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  67.8
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  ethyl 2-(6,7-difluoro-3-oxo-4H-quinoxalin-2-yl)acetate 在 sodium hydroxide 、 水 作用下， 反应 2.0h， 以93%的产率得到6,7-difluoro-3-methylquinoxalin-2(1H)-one
  参考文献：
  名称：

  Synthesis of 3,6,7-substituted-quinoxalin-2-ones for evaluation of antimicrobial and anticancer activity. Part 2

  摘要：

  A new set of 35 3-alkyl and 3-ethoxycarbonylalkyl 6- and/or 7-substituted-2-quinoxalinones was prepared and submitted to a preliminary in vitro investigation of their antimicrobial, anticancer and anti-HIV activities. Results are referred. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(99)00010-5
• 作为产物：
  描述：

  4,5-二氟苯-1,2-二胺 、 sodium 1,4-diethoxy-1,4-dioxobut-2-en-2-olate 在 溶剂黄146 作用下， 以 乙醇 为溶剂， 反应 2.0h， 以55.7%的产率得到ethyl 2-(6,7-difluoro-3-oxo-4H-quinoxalin-2-yl)acetate
  参考文献：
  名称：

  Synthesis of 3,6,7-substituted-quinoxalin-2-ones for evaluation of antimicrobial and anticancer activity. Part 2

  摘要：

  A new set of 35 3-alkyl and 3-ethoxycarbonylalkyl 6- and/or 7-substituted-2-quinoxalinones was prepared and submitted to a preliminary in vitro investigation of their antimicrobial, anticancer and anti-HIV activities. Results are referred. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(99)00010-5

文献信息

• Synthesis of 3,6,7-substituted-quinoxalin-2-ones for evaluation of antimicrobial and anticancer activity. Part 2
  作者：Paolo Sanna、Antonio Carta、Mario Loriga、Stefania Zanetti、Leonardo Sechi

  DOI：10.1016/s0014-827x(99)00010-5

  日期：1999.3

  A new set of 35 3-alkyl and 3-ethoxycarbonylalkyl 6- and/or 7-substituted-2-quinoxalinones was prepared and submitted to a preliminary in vitro investigation of their antimicrobial, anticancer and anti-HIV activities. Results are referred. (C) 1999 Elsevier Science S.A. All rights reserved.