4-(5-trichloromethyl[1,2,4]oxadiazol-3-yl)-furazan-3-ylamine | 163011-67-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 亚胺内酰胺
• 英文名称: 4-(5-trichloromethyl[1,2,4]oxadiazol-3-yl)-furazan-3-ylamine
• 英文别名: 3-(4-aminofurazan-3-yl)-5-trichloromethyl-1,2,4-oxadiazole；4-[5-(Trichloromethyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
• CAS: 163011-67-4
• 化学式: C₅H₂Cl₃N₅O₂
• 分子量: 270.462
• InChiKey: ZBFZEPFXCWFEIP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  104
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  4-(5-trichloromethyl[1,2,4]oxadiazol-3-yl)-furazan-3-ylamine 以 ammonium hydroxide 为溶剂， 以87%的产率得到3-(4-aminofurazan-3-yl)-4H-[1,2,4]oxadiazol-5-one
  参考文献：
  名称：

  Synthesis of Furazane Conjugated New Heterocycles

  摘要：

  An improved route for the synthesis of 3-(4-aminofnrazane-3-yl)-1,2,4-oxadiazole heterocycles using micro-wave irradiation is reported. The preparation of novel 4-(thiazol-4-yl)furazan-3-ylamine, 4-(pyrimidin-4-yl)furazan-3-ylamine and, 4-(pyrazolidin-3-yl)furazan-3-ylamine heterocycles are described.

  DOI：

  10.3987/com-03-9833
• 作为产物：
  描述：

  2,2,2-trichloro-N-[4-[5-(trichloromethyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-yl]acetamide 在 乙烷,三氯氟- 作用下， 以 乙醇 为溶剂， 反应 19.0h， 以81%的产率得到4-(5-trichloromethyl[1,2,4]oxadiazol-3-yl)-furazan-3-ylamine
  参考文献：
  名称：

  Synthesis of Furazane Conjugated New Heterocycles

  摘要：

  An improved route for the synthesis of 3-(4-aminofnrazane-3-yl)-1,2,4-oxadiazole heterocycles using micro-wave irradiation is reported. The preparation of novel 4-(thiazol-4-yl)furazan-3-ylamine, 4-(pyrimidin-4-yl)furazan-3-ylamine and, 4-(pyrazolidin-3-yl)furazan-3-ylamine heterocycles are described.

  DOI：

  10.3987/com-03-9833

文献信息

• New functionalized aminofurazans as potential antimitotic agents in the sea urchin embryo assay
  作者：Aleksei B. Sheremetev、Dmitrii E. Dmitriev、Nataliya K. Lagutina、Mikhail M. Raihstat、Alex S. Kiselyov、Marina N. Semenova、Natalie N. Ikizalp、Victor V. Semenov

  DOI：10.1016/j.mencom.2010.05.002

  日期：2010.5

  A series of new furazan (1,2,5-oxadiazole) derivatives based on structural overlap with combretastatin have been synthesized. Targeted molecules were evaluated using the sea urchin embryo assay; several agents demonstrated 1-4 mu mol dm(-3) antiproliferative activity in this in vivo model.
• Ring formation reactions of 4-aminofurazan-3-carboxyamidoximfs
  作者：V. G. Andrianov、E. N. Rozhkov、A. V. Eremeev

  DOI：10.1007/bf01169945

  日期：1994.4
• Synthesis of Furazane Conjugated New Heterocycles
  作者：Renaud Beaudegnies、Sebastian Wendeborn

  DOI：10.3987/com-03-9833

  日期：——

  An improved route for the synthesis of 3-(4-aminofnrazane-3-yl)-1,2,4-oxadiazole heterocycles using micro-wave irradiation is reported. The preparation of novel 4-(thiazol-4-yl)furazan-3-ylamine, 4-(pyrimidin-4-yl)furazan-3-ylamine and, 4-(pyrazolidin-3-yl)furazan-3-ylamine heterocycles are described.