3,5-dinitro-2-(p-tolylsulfanyl)thiophene | 21817-38-9

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 3,5-dinitro-2-(p-tolylsulfanyl)thiophene
• 英文别名: 2-(4-Methylphenyl)sulfanyl-3,5-dinitrothiophene；2-(4-methylphenyl)sulfanyl-3,5-dinitrothiophene
• CAS: 21817-38-9
• 化学式: C₁₁H₈N₂O₄S₂
• 分子量: 296.328
• InChiKey: NXCTVXJIUSOFQK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  145
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  2-bromo-3,5-dinitro-thiophene 、 4-甲苯硫酚 在 4-叔丁基杯[8]芳烃 作用下， 以 水 为溶剂， 反应 2.5h， 以85%的产率得到3,5-dinitro-2-(p-tolylsulfanyl)thiophene
  参考文献：
  名称：

  p-tert-Butylcalix[8]arene catalysed synthesis of 3,5-dinitrothiophene scaffolds: antiproliferative effect of some representative compounds on selective anticancer cell lines

  摘要：

  A new efficient protocol for the synthesis of 3,5-dinitrothiophene scaffolds was developed by using simple p-tert-butylcalix[8]arene in aqueous medium. Biological activities of some representative compounds were also studied to inhibit the cell growth on selective anticancer cell lines. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2013.12.068

文献信息

• p-tert-Butylcalix[8]arene catalysed synthesis of 3,5-dinitrothiophene scaffolds: antiproliferative effect of some representative compounds on selective anticancer cell lines
  作者：Piyali Sarkar、Samares Maiti、Krishnendu Ghosh、Sumita Sengupta (Bandyopadhyay)、Ray J. Butcher、Chhanda Mukhopadhyay

  DOI：10.1016/j.tetlet.2013.12.068

  日期：2014.1

  A new efficient protocol for the synthesis of 3,5-dinitrothiophene scaffolds was developed by using simple p-tert-butylcalix[8]arene in aqueous medium. Biological activities of some representative compounds were also studied to inhibit the cell growth on selective anticancer cell lines. (C) 2013 Elsevier Ltd. All rights reserved.