[N-(4-chloro-3-methoxyphenyl)-β-(4-methoxyphenyl)-β-oxo]propanamide | 1402932-00-6

• 英文名称: [N-(4-chloro-3-methoxyphenyl)-β-(4-methoxyphenyl)-β-oxo]propanamide
• CAS: 1402932-00-6
• 化学式: C₁₇H₁₆ClNO₄
• 分子量: 333.771
• InChiKey: GNRRKUICISPKRY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.57
• 重原子数：
  23.0
• 可旋转键数：
  6.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  64.63
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  [N-(4-chloro-3-methoxyphenyl)-β-(4-methoxyphenyl)-β-oxo]propanamide 在 polyphosphoric acid 作用下， 以90%的产率得到6-chloro-4-(p-methoxyphenyl)-7-methoxy-2(1H)-quinolinone
  参考文献：
  名称：

  Synthesis and Evaluation of 4-Aryl-2(1H)-quinolinones as Potent Amyloid β Fibrillogenesis Inhibitors

  摘要：

  4-Aryl-2(1H)-quinolinones were synthesized and evaluated in vitro as inhibitors of A beta(1-42) fibrillogenesis using a thioflavin T fluorescence method. The most potent anti-aggregating molecules (4b and 5c) were found among the derivatives bearing OH and/or OMe groups at C-4' (R-4) and/or C-6 (R-2) of the 4-aryl-2(1H)-quinolinone moiety. Furthermore, the derivative bearing 4'-F substituent (4f) proved to be a very active inhibitor.

  DOI：

  10.3987/com-12-12506
• 作为产物：
  描述：

  3-甲氧基-4-氯苯胺 、 3-(4-甲氧苯基)-3-氧代丙酸乙酯 以 吡啶 为溶剂， 以73%的产率得到[N-(4-chloro-3-methoxyphenyl)-β-(4-methoxyphenyl)-β-oxo]propanamide
  参考文献：
  名称：

  Synthesis and Evaluation of 4-Aryl-2(1H)-quinolinones as Potent Amyloid β Fibrillogenesis Inhibitors

  摘要：

  4-Aryl-2(1H)-quinolinones were synthesized and evaluated in vitro as inhibitors of A beta(1-42) fibrillogenesis using a thioflavin T fluorescence method. The most potent anti-aggregating molecules (4b and 5c) were found among the derivatives bearing OH and/or OMe groups at C-4' (R-4) and/or C-6 (R-2) of the 4-aryl-2(1H)-quinolinone moiety. Furthermore, the derivative bearing 4'-F substituent (4f) proved to be a very active inhibitor.

  DOI：

  10.3987/com-12-12506