ethyl 4-(benzyl(2-(tert-butylamino)-2-oxo-1-phenylethyl)amino)-5-oxo-1,2-diphenyl-2,5-dihydro-1H-pyrrole-3-carboxylate

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: ethyl 4-(benzyl(2-(tert-butylamino)-2-oxo-1-phenylethyl)amino)-5-oxo-1,2-diphenyl-2,5-dihydro-1H-pyrrole-3-carboxylate
• 英文别名: ethyl 4-[benzyl-[2-(tert-butylamino)-2-oxo-1-phenylethyl]amino]-5-oxo-1,2-diphenyl-2H-pyrrole-3-carboxylate
• 化学式: C₃₈H₃₉N₃O₄
• 分子量: 601.745
• InChiKey: GFQHHMPDDQHVFJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.9
• 重原子数：
  45
• 可旋转键数：
  12
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  79
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  sodium diethylmalonate 在 硫酸 、 水 、 sodium sulfate 作用下， 以 甲醇 、 乙醚 为溶剂， 反应 48.5h， 生成 ethyl 4-(benzyl(2-(tert-butylamino)-2-oxo-1-phenylethyl)amino)-5-oxo-1,2-diphenyl-2,5-dihydro-1H-pyrrole-3-carboxylate
  参考文献：
  名称：

  Enols as Feasible Acid Components in the Ugi Condensation

  摘要：

  Heterocyclic enols are used for the first time as acid components in an Ugi-type multicomponent condensation. For that purpose, we have chosen enols containing a Michael acceptor, in order to facilitate an irreversible rearrangement of the primary Ugi adduct. The new four-component process leads readily and efficiently to heterocyclic enamines containing at least six elements of diversity.

  DOI：

  10.1021/ol302976g

文献信息

• Enols as Feasible Acid Components in the Ugi Condensation
  作者：Teresa G. Castellano、Ana G. Neo、Stefano Marcaccini、Carlos F. Marcos

  DOI：10.1021/ol302976g

  日期：2012.12.21

  Heterocyclic enols are used for the first time as acid components in an Ugi-type multicomponent condensation. For that purpose, we have chosen enols containing a Michael acceptor, in order to facilitate an irreversible rearrangement of the primary Ugi adduct. The new four-component process leads readily and efficiently to heterocyclic enamines containing at least six elements of diversity.