Ethyl 4-[(7-methoxy-2-oxochromene-3-carbonyl)amino]benzoate

• 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: Ethyl 4-[(7-methoxy-2-oxochromene-3-carbonyl)amino]benzoate
• 化学式: C₂₀H₁₇NO₆
• 分子量: 367.358
• InChiKey: QGVYIGZCTZDUCA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  27
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  90.9
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  Ethyl 4-[(7-methoxy-2-oxochromene-3-carbonyl)amino]benzoate 在 水 、 lithium hydroxide 作用下， 以 甲醇 为溶剂， 反应 2.0h， 生成 4-{[(7-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}benzoic acid
  参考文献：
  名称：

  Synthesis, selective anti-Helicobacter pylori activity, and cytotoxicity of novel N-substituted-2-oxo-2H-1-benzopyran-3-carboxamides

  摘要：

  N-substituted-3-carboxamido-coumarin derivatives were prepared and evaluated for selective antibacterial activity against 20 isolates of Helicobacter pylori clinical strains, including five metronidazole resistant ones. Some of them possessed the best activity against H. pylori metronidazole resistant strains with MIC values lower than the drug reference (metronidazole). Furthermore, anti-inflammatory activity through the inhibition of the IL-8 production was investigated. (c) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.06.048
• 作为产物：
  描述：

  3-氯甲酰基-7-甲氧基香豆素 、 苯佐卡因 以 乙醚 为溶剂， 生成 Ethyl 4-[(7-methoxy-2-oxochromene-3-carbonyl)amino]benzoate
  参考文献：
  名称：

  Synthesis, selective anti-Helicobacter pylori activity, and cytotoxicity of novel N-substituted-2-oxo-2H-1-benzopyran-3-carboxamides

  摘要：

  N-substituted-3-carboxamido-coumarin derivatives were prepared and evaluated for selective antibacterial activity against 20 isolates of Helicobacter pylori clinical strains, including five metronidazole resistant ones. Some of them possessed the best activity against H. pylori metronidazole resistant strains with MIC values lower than the drug reference (metronidazole). Furthermore, anti-inflammatory activity through the inhibition of the IL-8 production was investigated. (c) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.06.048