3-{4-[(4-methoxyphenyl)amino]-1,2,5-oxadiazol-3-yl}-N-(pyridin-3-ylmethyl)-1,2,4-oxadiazol-5-amine | 924822-99-1

• 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: 3-{4-[(4-methoxyphenyl)amino]-1,2,5-oxadiazol-3-yl}-N-(pyridin-3-ylmethyl)-1,2,4-oxadiazol-5-amine
• 英文别名: N-(4-methoxyphenyl)-4-[5-(pyridin-3-ylmethylamino)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
• CAS: 924822-99-1
• 化学式: C₁₇H₁₅N₇O₃
• mdl: MFCD09062791
• 分子量: 365.351
• InChiKey: ZVBWNWSLEGTOOO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  124
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  4-(p-methoxyphenylamino)furazan-3-carboxamidoxime 以 四氢呋喃 、 乙酸丁酯 为溶剂， 生成 3-{4-[(4-methoxyphenyl)amino]-1,2,5-oxadiazol-3-yl}-N-(pyridin-3-ylmethyl)-1,2,4-oxadiazol-5-amine
  参考文献：
  名称：

  New functionalized aminofurazans as potential antimitotic agents in the sea urchin embryo assay

  摘要：

  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.

  DOI：

  10.1016/j.mencom.2010.05.002

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.