2-(2-((1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl)methoxy)phenyl)benzo[d]thiazole | 1396390-55-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-(2-((1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl)methoxy)phenyl)benzo[d]thiazole
• 英文别名: 2-[2-[[1-(4-Fluorophenyl)triazol-4-yl]methoxy]phenyl]-1,3-benzothiazole
• CAS: 1396390-55-8
• 化学式: C₂₂H₁₅FN₄OS
• 分子量: 402.452
• InChiKey: DYYJMMDAXUQJOP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  29
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  81.1
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  2-氨基苯硫醇 在 copper(l) iodide 、 ammonium cerium (IV) nitrate 、 双氧水 、 potassium carbonate 作用下， 以 四氢呋喃 、 丙酮 为溶剂， 反应 26.0h， 生成 2-(2-((1-(4-fluorophenyl)-1H-1,2,3-triazol-4-yl)methoxy)phenyl)benzo[d]thiazole
  参考文献：
  名称：

  Synthesis and biological evaluation of novel triazoles and isoxazoles linked 2-phenyl benzothiazole as potential anticancer agents

  摘要：

  A new series of isoxazoles and triazoles linked 2-phenyl benzothiazole were synthesized and evaluated for their anticancer activity. These compounds have been tested for their cytotoxicity against three cancer cell lines. Among the compounds tested, compound 5d showed good cytotoxicity against Colo-205 and A549 cells in comparison to standard control PMX 610(1). Further compound 5d has been tested for its apoptotic activity and its inhibitory activity against caspase and PARP proteins. Hence this compound has the potential that it can be selected for further biological studies. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.07.041