2-(4-(benzyloxy)-4-oxobutanamido)-2-((((S)-2-(6-methoxynaphthalen-2-yl)propanoyl)oxy)methyl)propane-1,3-diyl (2S,2'S)-bis(2-(6-methoxynaphthalen-2-yl)propanoate) | 1228151-34-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-(4-(benzyloxy)-4-oxobutanamido)-2-((((S)-2-(6-methoxynaphthalen-2-yl)propanoyl)oxy)methyl)propane-1,3-diyl (2S,2'S)-bis(2-(6-methoxynaphthalen-2-yl)propanoate)
• CAS: 1228151-34-5
• 化学式: C₅₇H₅₇NO₁₂
• 分子量: 948.079
• InChiKey: KBSCNURAWLAMEM-QXUSSCGESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.89
• 重原子数：
  70.0
• 可旋转键数：
  21.0
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  161.99
• 氢给体数：
  1.0
• 氢受体数：
  12.0

反应信息

• 作为反应物：
  描述：

  2-(4-(benzyloxy)-4-oxobutanamido)-2-((((S)-2-(6-methoxynaphthalen-2-yl)propanoyl)oxy)methyl)propane-1,3-diyl (2S,2'S)-bis(2-(6-methoxynaphthalen-2-yl)propanoate) 在 palladium 10% on activated carbon 、 氢气 作用下， 以 甲醇 为溶剂， 反应 24.0h， 以96%的产率得到
  参考文献：
  名称：

  Synthesis of first generation Janus-Type dendrimers bearing Asp oligopeptides and naproxen

  摘要：

  To construct a water-soluble and bone-targeting non-steroidal anti-inflammatory dendritic drug carrier, a series of Asp oligopeptides and naproxen based poly amido-ester Janus dendrimers were synthesized using a conventional method and their water solubility was preliminary evaluated. The corresponding small dendritic linkers contain two or three drug moieties on the surface and two or three oligopeptides groups at the focal terminus. This design provided an effective entry for the synthesis of multiple drug carriers with water-soluble and bone-targeting.

  DOI：

  10.3998/ark.5550190.0011.221
• 作为产物：
  描述：

  2-amino-2-((((S)-2-(6-methoxynaphthalen-2-yl)propanoyl)oxy)methyl)propane-1,3-diyl (2S,2'S)-bis(2-(6-methoxynaphthalen-2-yl)propanoate) 、 琥珀酸苄酯 在 氯甲酸异丁酯 作用下， 以 四氢呋喃 为溶剂， 以40.5%的产率得到2-(4-(benzyloxy)-4-oxobutanamido)-2-((((S)-2-(6-methoxynaphthalen-2-yl)propanoyl)oxy)methyl)propane-1,3-diyl (2S,2'S)-bis(2-(6-methoxynaphthalen-2-yl)propanoate)
  参考文献：
  名称：

  Synthesis of first generation Janus-Type dendrimers bearing Asp oligopeptides and naproxen

  摘要：

  To construct a water-soluble and bone-targeting non-steroidal anti-inflammatory dendritic drug carrier, a series of Asp oligopeptides and naproxen based poly amido-ester Janus dendrimers were synthesized using a conventional method and their water solubility was preliminary evaluated. The corresponding small dendritic linkers contain two or three drug moieties on the surface and two or three oligopeptides groups at the focal terminus. This design provided an effective entry for the synthesis of multiple drug carriers with water-soluble and bone-targeting.

  DOI：

  10.3998/ark.5550190.0011.221