2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]-4,5-diphenylfuran-3-carbonitrile | 384846-44-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 呋喃
• 英文名称: 2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]-4,5-diphenylfuran-3-carbonitrile
• CAS: 384846-44-0
• 化学式: C₂₅H₂₂N₂O₂
• 分子量: 382.462
• InChiKey: OKNVRVKGXGRYKE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.9
• 重原子数：
  29
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  66
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-氯苄亚基丙二腈 、 2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]-4,5-diphenylfuran-3-carbonitrile 在 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 乙醇 为溶剂， 以56%的产率得到4-amino-7-(4-chlorophenyl)-10,10-dimethyl-2,3-diphenyl-8-oxo-8,9,10,11-tetrahydro-7H-furo[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
  参考文献：
  名称：

  摘要：

  The reactions of cyclic enaminoketones with benzylidenemalonitriles were examined and a new procedure was developed for the synthesis of fused heterocyclic systems containing the 1,4-dihydropyridine ring, viz., thienopyrimidoquinolines and furopyrimidoquinolines. The characteristic features of the reactions and the Structures Of the resulting compounds were investigated.

  DOI：

  10.1023/a:1015056117968
• 作为产物：
  描述：

  2-氨基-4,5-二苯基-3-呋喃甲腈 、 5,5-二甲基-1,3-环己二酮 在 对甲苯磺酸 作用下， 以 苯 为溶剂， 反应 5.0h， 以83%的产率得到2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]-4,5-diphenylfuran-3-carbonitrile
  参考文献：
  名称：

  摘要：

  The reactions of cyclic enaminoketones with benzylidenemalonitriles were examined and a new procedure was developed for the synthesis of fused heterocyclic systems containing the 1,4-dihydropyridine ring, viz., thienopyrimidoquinolines and furopyrimidoquinolines. The characteristic features of the reactions and the Structures Of the resulting compounds were investigated.

  DOI：

  10.1023/a:1015056117968

文献信息

• ——
  作者：B. V. Lichitsky、S. N. Ivanov、A. A. Dudinov、S. A. Woznesensky、M. M. Krayushkin

  DOI：10.1023/a:1015056117968

  日期：——

  The reactions of cyclic enaminoketones with benzylidenemalonitriles were examined and a new procedure was developed for the synthesis of fused heterocyclic systems containing the 1,4-dihydropyridine ring, viz., thienopyrimidoquinolines and furopyrimidoquinolines. The characteristic features of the reactions and the Structures Of the resulting compounds were investigated.