2-amino-4-pentyl-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile | 1394283-84-1

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2-amino-4-pentyl-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile
• 英文别名: 2-Amino-4-pentyl-6-phenylsulfanylpyridine-3,5-dicarbonitrile；2-amino-4-pentyl-6-phenylsulfanylpyridine-3,5-dicarbonitrile
• CAS: 1394283-84-1
• 化学式: C₁₈H₁₈N₄S
• 分子量: 322.434
• InChiKey: CPKOPOPYJSIZHQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  112
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  正己醛 、 苯硫酚 、 丙二腈 在 C₆H₄O₆S₂^(2-)*2C₁₂H₁₀N₂*Cd⁽²⁺⁾*4H₂O 作用下， 反应 1.0h， 以61%的产率得到2-amino-4-pentyl-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile
  参考文献：
  名称：

  Multi-component synthesis of 2-amino-6-(alkylthio)pyridine-3,5-dicarbonitriles using Zn(II) and Cd(II) metal–organic frameworks (MOFs) under solvent-free conditions

  摘要：

  Multi-component synthesis of 2-amino-3,5-dicarbonitrile-6-thio-pyridines has been developed by using the reaction of aldehydes, malononitrile, and thiophenols in the presence of a Zn(II) or a Cd(II) metal-organic framework (MOF) as the heterogeneous catalyst. This protocol tolerates different functional groups on the substrates and does not require the use of any organic solvent. Moreover, the Zn(II) and Cd(II) MOF catalysts can be recovered and reused for a number of runs without loss of activity. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.06.139

文献信息

• Multi-component synthesis of 2-amino-6-(alkylthio)pyridine-3,5-dicarbonitriles using Zn(II) and Cd(II) metal–organic frameworks (MOFs) under solvent-free conditions
  作者：Muralidhara Thimmaiah、Peng Li、Sridhar Regati、Banglin Chen、John Cong-Gui Zhao

  DOI：10.1016/j.tetlet.2012.06.139

  日期：2012.9

  Multi-component synthesis of 2-amino-3,5-dicarbonitrile-6-thio-pyridines has been developed by using the reaction of aldehydes, malononitrile, and thiophenols in the presence of a Zn(II) or a Cd(II) metal-organic framework (MOF) as the heterogeneous catalyst. This protocol tolerates different functional groups on the substrates and does not require the use of any organic solvent. Moreover, the Zn(II) and Cd(II) MOF catalysts can be recovered and reused for a number of runs without loss of activity. (C) 2012 Elsevier Ltd. All rights reserved.