4-phenyl-furazan-3-carbonitrile | 857820-75-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-phenyl-furazan-3-carbonitrile
• 英文别名: phenyl-furazancarbonitrile；Phenyl-furazancarbonitril；Cyan-phenyl-furazan；3-Cyano-4-phenyl-1,2,5-oxadiazole；4-phenyl-1,2,5-oxadiazole-3-carbonitrile
• CAS: 857820-75-8
• 化学式: C₉H₅N₃O
• 分子量: 171.158
• InChiKey: RESNQQCIPPNVPZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  62.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-phenyl-furazan-3-carbonitrile 在 sodium hydroxide 作用下， 生成 4-phenyl-3-furazancarboxylic acid
  参考文献：
  名称：

  Ponzio, Gazzetta Chimica Italiana, 1931, vol. 61, p. 943,951

  摘要：

  DOI：
• 作为产物：
  描述：

  3-phenyl-4-cyano-furoxan 在 三甲氧基磷 作用下， 反应 3.0h， 以90%的产率得到4-phenyl-furazan-3-carbonitrile
  参考文献：
  名称：

  Glutathione potentiates cGNP synthesis induced by the two phenylfuroxancarbonitrile isomers in RFL-6 cells

  摘要：

  The cellular mechanism of bioactivation underlying guanylate cyclase activation by the pair of phenylfuroxancarbonitrile isomers 2a, b was investigated. In cultured rat lung fibroblast (RFL-6 cells) it was principally dependent on intracellular thiols. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/0960-894x(96)00479-9

文献信息

• Synthesis of oxadiazole-2-oxide analogues as potential antischistosomal agents
  作者：Ganesha Rai、Craig J. Thomas、William Leister、David J. Maloney

  DOI：10.1016/j.tetlet.2009.01.120

  日期：2009.4

  The synthesis of several 1,2,5-oxadiazole-2-oxide (Furoxan) analogues is described herein. These compounds were prepared in an effort to probe the SAR around the phenyl substituent and oxadiazole core for our studies toward thioredoxin-glutathione reductase (TGR) inhibition and antischistosomal activity. Published by Elsevier Ltd.
• Ponzio, Gazzetta Chimica Italiana, 1931, vol. 61, p. 943,951
  作者：Ponzio

  DOI：——

  日期：——
• Glutathione potentiates cGNP synthesis induced by the two phenylfuroxancarbonitrile isomers in RFL-6 cells
  作者：A. Di Stilo、C. Cena、A.M. Gasco、A. Gasco、D. Ghigo、A. Bosia

  DOI：10.1016/0960-894x(96)00479-9

  日期：1996.11

  The cellular mechanism of bioactivation underlying guanylate cyclase activation by the pair of phenylfuroxancarbonitrile isomers 2a, b was investigated. In cultured rat lung fibroblast (RFL-6 cells) it was principally dependent on intracellular thiols. Copyright (C) 1996 Elsevier Science Ltd