methyl 4-(N,N-diethylcarbamoyl)butyrate | 30428-74-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: methyl 4-(N,N-diethylcarbamoyl)butyrate
• 英文别名: Glutarsaeurediethylmonoamidmethylester；N,N-diethyl-glutaramic acid methyl ester；N,N-Diaethyl-glutaramidsaeure-methylester；Methyl 5-(diethylamino)-5-oxopentanoate
• CAS: 30428-74-1
• 化学式: C₁₀H₁₉NO₃
• 分子量: 201.266
• InChiKey: PRFNMZJBASGWBD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  14
• 可旋转键数：
  7
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  46.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  methyl 4-(N,N-diethylcarbamoyl)butyrate 在 Schwartz's reagent 作用下， 反应 0.25h， 以74%的产率得到5-氧代戊酸甲酯
  参考文献：
  名称：

  Chemoselective Reduction by Cp2Zr(H)Cl (Schwartz's Reagent)

  摘要：

  DOI：

  10.1071/ch03321
• 作为产物：
  描述：

  4-氯甲酰基丁酸甲酯 、 二乙胺 以 苯 为溶剂， 以67%的产率得到methyl 4-(N,N-diethylcarbamoyl)butyrate
  参考文献：
  名称：

  Analogs of 8-[[6-(diethylamino)hexyl]amino]-6-methoxy-4-methylquinoline as candidate antileishmanial agents

  摘要：

  8-[[6-(Diethylamino)hexyl]amino]-6-methoxy-4-methylquinoline (I) has been shown to be highly effective against Leishmania donovani in hamsters, being approximately 475 times as active as the standard meglumine antimoniate. Several nuclear and side-chain analogues of I have been prepared in an attempt to further enhance the antileishmanial activity of this class of compounds. The compounds were tested against L. donovani in the golden hamster. Although several analogues had meglumine antimoniate indexes in excess of 300, none was superior to the model compound.

  DOI：

  10.1021/jm00183a004

文献信息

• US2627487
  申请人：——

  公开号：——

  公开（公告）日：——
• DAGLI D.; KHAN M. S.; BLUMBERGS P., J. MED. CHEM., 1980, 23, NO 9, 981-985
  作者：DAGLI D.、 KHAN M. S.、 BLUMBERGS P.

  DOI：——

  日期：——