2-methoxy-4-methylphenyl 2-(4-isobutylphenyl)propanoate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 2-methoxy-4-methylphenyl 2-(4-isobutylphenyl)propanoate
• 英文别名: 2-Methoxy-4-methylphenyl 2-(4-isobutylphenyl)propanoate；(2-methoxy-4-methylphenyl) 2-[4-(2-methylpropyl)phenyl]propanoate
• 化学式: C₂₁H₂₆O₃
• 分子量: 326.436
• InChiKey: YKMMXXXNUBVDJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  24
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-甲氧基-4-甲基苯酚 、 布洛芬 在 4-二甲氨基吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 以51%的产率得到2-methoxy-4-methylphenyl 2-(4-isobutylphenyl)propanoate
  参考文献：
  名称：

  Compounds against inflammation and oxidative insult as potential agents for neurodegenerative disorders

  摘要：

  Amides of proline, a feature encountered in nootropics, via the carboxylic group of ibuprofen, indomethacin, ketoprofen and naproxen were prepared. Proline carboxylic group was amidated or esterified with potential antioxidant or neuroprotective compounds. Proline was replaced by 4-hydroxyproline, 2-pipecolic acid or omitted, for investigating the contribution of structure to activity. Anti-inflammatory activity was determined, and selected compounds were examined for anti-dyslipidemic action, protection against brain ischaemia/reperfusion and brain penetration.Amides of proline and related structures with NSAIDs were synthesized. They were amidated or esterified with antioxidant or neuroprotective compounds. Activity against lipid peroxidation, inflammation and brain ischaemia was evaluated.

  DOI：

  10.1007/s00044-011-9726-x

文献信息

• Compounds against inflammation and oxidative insult as potential agents for neurodegenerative disorders
  作者：Christos M. Doulgkeris、Ioanna C. Siskou、Nikoletta Xanthopoulou、Vassiliki Lagouri、Constantina Kravaritou、Phaedra Eleftheriou、Panos N. Kourounakis、Eleni A. Rekka

  DOI：10.1007/s00044-011-9726-x

  日期：2012.9

  Amides of proline, a feature encountered in nootropics, via the carboxylic group of ibuprofen, indomethacin, ketoprofen and naproxen were prepared. Proline carboxylic group was amidated or esterified with potential antioxidant or neuroprotective compounds. Proline was replaced by 4-hydroxyproline, 2-pipecolic acid or omitted, for investigating the contribution of structure to activity. Anti-inflammatory activity was determined, and selected compounds were examined for anti-dyslipidemic action, protection against brain ischaemia/reperfusion and brain penetration.Amides of proline and related structures with NSAIDs were synthesized. They were amidated or esterified with antioxidant or neuroprotective compounds. Activity against lipid peroxidation, inflammation and brain ischaemia was evaluated.