8-hydroxyquinoline,anthranilic acid | 491856-82-7

• 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: 8-hydroxyquinoline,anthranilic acid
• 英文别名: 2-Amino-benzoic acid quinolin-8-yl ester；quinolin-8-yl 2-aminobenzoate
• CAS: 491856-82-7
• 化学式: C₁₆H₁₂N₂O₂
• 分子量: 264.283
• InChiKey: VIANMXBAVGPAGW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  20
• 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：
  65.2
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  邻氨基苯甲酸 在 氯化亚砜 作用下， 以 乙醚 为溶剂， 反应 4.5h， 生成 8-hydroxyquinoline,anthranilic acid
  参考文献：
  名称：

  Synthesis, antimicrobial evaluation, ot-QSAR and mt-QSAR studies of 2-amino benzoic acid derivatives

  摘要：

  A series of 2-amino benzoic acid derivatives (1-28) were synthesized and evaluated for their in vitro antimicrobial activity against the panel of Gram positive, Gram negative bacterial and fungal strains. The results of antimicrobial studies indicated that, in general, the synthesized compounds were found to be bacteriostatic and fungistatic in action. QSAR studies performed by the development of one target and multi target models indicated that multi-target model was effective in describing the antimicrobial activity as well demonstrated the effect of structural parameters viz. LUMO, (3)chi(v) and W on antimicrobial activity of 2-amino benzoic acid derivatives.

  DOI：

  10.1007/s00044-010-9537-5