2-chloro-6-<2,5-dimethyl-3-(methoxycarbonyl)furan-4-yl>-3-formylquinoline | 121497-04-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 2-chloro-6-<2,5-dimethyl-3-(methoxycarbonyl)furan-4-yl>-3-formylquinoline
• 英文别名: methyl 4-(2-chloro-3-formylquinolin-6-yl)-2,5-dimethylfuran-3-carboxylate
• CAS: 121497-04-9
• 化学式: C₁₈H₁₄ClNO₄
• 分子量: 343.766
• InChiKey: FUVMVKKLEHRWQJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.36
• 重原子数：
  24.0
• 可旋转键数：
  3.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  69.4
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  2-chloro-6-<2,5-dimethyl-3-(methoxycarbonyl)furan-4-yl>-3-formylquinoline 、 3-氨基巴豆酸甲酯 以 乙二醇 为溶剂， 反应 24.0h， 以65%的产率得到4-[2-Chloro-6-(4-methoxycarbonyl-2,5-dimethyl-furan-3-yl)-quinolin-3-yl]-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid dimethyl ester
  参考文献：
  名称：

  Syntheses and bioevaluation of substituted dihydropyridines for pregnancy-interceptive activity in hamsters

  摘要：

  A number of 2,6-dimethyl-3,5-bis(methoxycarbonyl)-4-substituted-1,4- dihydropyridines were synthesized and evaluated for pregnancy-interceptive activity in mated hamsters. Out of 24 compounds, 12, 15, 21, 22, 28, and 34 caused a marked reduction in the number of implantations when administered on days 3-8 postcoitum. In an in vitro competition assay, none of the compounds exhibited noticeable binding affinity for uterine progesterone receptors. The results reported here have helped to identify new leads for developing pregnancy-interceptive agents and the active compounds do not seem to elicit their interceptive effect through receptor-mediated inhibition of progesterone action in hamster uterus.

  DOI：

  10.1021/jm00130a012
• 作为产物：
  描述：

  N,N-二甲基甲酰胺 、 3-Furancarboxylic acid, 4-[4-(acetylamino)phenyl]-2,5-dimethyl-, methylester 在 三氯氧磷 作用下， 反应 16.0h， 以50%的产率得到2-chloro-6-<2,5-dimethyl-3-(methoxycarbonyl)furan-4-yl>-3-formylquinoline
  参考文献：
  名称：

  Syntheses and bioevaluation of substituted dihydropyridines for pregnancy-interceptive activity in hamsters

  摘要：

  A number of 2,6-dimethyl-3,5-bis(methoxycarbonyl)-4-substituted-1,4- dihydropyridines were synthesized and evaluated for pregnancy-interceptive activity in mated hamsters. Out of 24 compounds, 12, 15, 21, 22, 28, and 34 caused a marked reduction in the number of implantations when administered on days 3-8 postcoitum. In an in vitro competition assay, none of the compounds exhibited noticeable binding affinity for uterine progesterone receptors. The results reported here have helped to identify new leads for developing pregnancy-interceptive agents and the active compounds do not seem to elicit their interceptive effect through receptor-mediated inhibition of progesterone action in hamster uterus.

  DOI：

  10.1021/jm00130a012

文献信息

• MUKHERJEE, ANITA;AKHTAR, MOHAMMAD S.;SHARMA, VISHNU L.;SETH, MANJU;BHADUR+, J. MED. CHEM., 32,(1989) N0, C. 2297-2300
  作者：MUKHERJEE, ANITA、AKHTAR, MOHAMMAD S.、SHARMA, VISHNU L.、SETH, MANJU、BHADUR+

  DOI：——

  日期：——