2-amino-4-(2-chloro-6-methoxyquinolin-3-yl)-6-[(4-chlorophenyl)sulfanyl]pyridine-3,5-dicarbonitrile | 1326315-76-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 2-amino-4-(2-chloro-6-methoxyquinolin-3-yl)-6-[(4-chlorophenyl)sulfanyl]pyridine-3,5-dicarbonitrile
• 英文别名: 2-Amino-4-(2-chloro-6-methoxy-3-quinolyl)-6-(4-chlorophenyl)sulfanyl-pyridine-3,5-dicarbonitrile；2-amino-4-(2-chloro-6-methoxyquinolin-3-yl)-6-(4-chlorophenyl)sulfanylpyridine-3,5-dicarbonitrile
• CAS: 1326315-76-7
• 化学式: C₂₃H₁₃Cl₂N₅OS
• 分子量: 478.361
• InChiKey: OYCCYEDJPFEOMC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  32
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  134
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  2-氯-6-甲氧基喹啉-3-甲醛 、 4-氯苯硫酚 、 丙二腈 在 哌啶 作用下， 以 乙醇 为溶剂， 反应 3.0h， 以57%的产率得到2-amino-4-(2-chloro-6-methoxyquinolin-3-yl)-6-[(4-chlorophenyl)sulfanyl]pyridine-3,5-dicarbonitrile
  参考文献：
  名称：

  Synthesis and in vitro antimicrobial evaluation of penta-substituted pyridine derivatives bearing the quinoline nucleus

  摘要：

  A new series of penta-substituted pyridine derivatives bearing the quinoline nucleus have been synthesized by base-catalyzed cyclocondensation reaction through multi-component reaction (MCR) approach. All the synthesized compounds were subjected to in vitro antimicrobial screening against three Gram positive bacteria (Bacillus subtilis, Clostridium tetani, Streptococcus pneumoniae), three Gram negative bacteria (Escherichia coli, Salmonella typhi, Vibrio cholerae), and two fungi (A. fumigatus, Candida albicans). Reviewing the data, majority of the compounds were found to be active against B. subtilis and C. tetani while the most effective compounds 4c and 4e demonstrated MIC 62.5 mu g/ml against V. cholerae and E. coli respectively.

  DOI：

  10.1007/s00044-011-9568-6

文献信息

• Synthesis and in vitro antimicrobial evaluation of penta-substituted pyridine derivatives bearing the quinoline nucleus
  作者：Jigar A. Makawana、Manish P. Patel、Ranjan G. Patel

  DOI：10.1007/s00044-011-9568-6

  日期：2012.5

  A new series of penta-substituted pyridine derivatives bearing the quinoline nucleus have been synthesized by base-catalyzed cyclocondensation reaction through multi-component reaction (MCR) approach. All the synthesized compounds were subjected to in vitro antimicrobial screening against three Gram positive bacteria (Bacillus subtilis, Clostridium tetani, Streptococcus pneumoniae), three Gram negative bacteria (Escherichia coli, Salmonella typhi, Vibrio cholerae), and two fungi (A. fumigatus, Candida albicans). Reviewing the data, majority of the compounds were found to be active against B. subtilis and C. tetani while the most effective compounds 4c and 4e demonstrated MIC 62.5 mu g/ml against V. cholerae and E. coli respectively.