9-hexyl-2-hydroxy-3-undecyl-6,7-dihydroacridine-1,4,8-(5H,8H,10H)-trione | 1448168-21-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 9-hexyl-2-hydroxy-3-undecyl-6,7-dihydroacridine-1,4,8-(5H,8H,10H)-trione
• CAS: 1448168-21-5
• 化学式: C₃₀H₄₅NO₄
• 分子量: 483.692
• InChiKey: GJFUQZHRHRGICN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.32
• 重原子数：
  35.0
• 可旋转键数：
  15.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  83.47
• 氢给体数：
  2.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  庚醛 、 恩贝酸/恩贝灵 、 3-氨基-2-环己烯-1-酮 以 乙醇 为溶剂， 反应 0.25h， 以93%的产率得到9-hexyl-2-hydroxy-3-undecyl-6,7-dihydroacridine-1,4,8-(5H,8H,10H)-trione
  参考文献：
  名称：

  Multicomponent Synthesis of Antibacterial Dihydropyridin and Dihydropyran Embelin Derivatives

  摘要：

  A series of dihydropyran and dihydropyridin embelin derivatives were synthesized through a novel and straightforward one-pot protocol based on a three-component reaction with embelin, aldehydes, and cyclic enaminones as synthetic imputs. The type of substituent on the nitrogen atom of the beta-enaminone is key to obtain nitrogenated or oxygenated rings. The obtained compounds were active against Gram-positive bacteria, including multiresistant Staphylococcus aureus clinical isolates.

  DOI：

  10.1021/jo401189x