1-[(S)-2-(6-Methoxy-naphthalen-2-yl)-propionyl]-piperidine-2-carboxylic acid | 908243-81-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-[(S)-2-(6-Methoxy-naphthalen-2-yl)-propionyl]-piperidine-2-carboxylic acid
• 英文别名: 1-[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]piperidine-2-carboxylic acid
• CAS: 908243-81-2
• 化学式: C₂₀H₂₃NO₄
• 分子量: 341.407
• InChiKey: JQBXQTQNMAGUDU-FVRDMJKUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  66.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-[(S)-2-(6-Methoxy-naphthalen-2-yl)-propionyl]-piperidine-2-carboxylic acid 、 L-半胱氨酸乙酯盐酸盐 在 N,N'-羰基二咪唑 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 25.0h， 生成
  参考文献：
  名称：

  Synthesis and pharmacochemical study of novel polyfunctional molecules combining anti-inflammatory, antioxidant, and hypocholesterolemic properties

  摘要：

  We have designed and synthesized a series of novel molecules having a residue of a classical NSAID and an antioxidant moiety, both attached through amide bonds to a known nootropic structure, an L-proline, frans-4-hydroxy-L-proline or DL-pipecolinic acid residue. The compounds were found to retain anti-inflammatory and antioxidant activities, to acquire hypocholesterolemic action, and to possess a greatly reduced gastrointestinal toxicity. The novel molecules could find useful applications, among others, in slowing the progression or delaying the onset of neurodegenerative diseases. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.11.027
• 作为产物：
  描述：

  萘普生 在 sodium hydroxide 、 草酰氯 作用下， 以 二氯甲烷 为溶剂， 反应 4.5h， 生成 1-[(S)-2-(6-Methoxy-naphthalen-2-yl)-propionyl]-piperidine-2-carboxylic acid
  参考文献：
  名称：

  Synthesis and pharmacochemical study of novel polyfunctional molecules combining anti-inflammatory, antioxidant, and hypocholesterolemic properties

  摘要：

  We have designed and synthesized a series of novel molecules having a residue of a classical NSAID and an antioxidant moiety, both attached through amide bonds to a known nootropic structure, an L-proline, frans-4-hydroxy-L-proline or DL-pipecolinic acid residue. The compounds were found to retain anti-inflammatory and antioxidant activities, to acquire hypocholesterolemic action, and to possess a greatly reduced gastrointestinal toxicity. The novel molecules could find useful applications, among others, in slowing the progression or delaying the onset of neurodegenerative diseases. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.11.027