1-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)-4-((4-methoxyphenyl)diazenyl)-1H-pyrazole-3,5-diamine | 1239368-81-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 1-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)-4-((4-methoxyphenyl)diazenyl)-1H-pyrazole-3,5-diamine
• CAS: 1239368-81-0
• 化学式: C₂₇H₂₂N₁₀O
• 分子量: 502.538
• InChiKey: NOCPTSBLPBUHJO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.46
• 重原子数：
  38.0
• 可旋转键数：
  6.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  158.27
• 氢给体数：
  3.0
• 氢受体数：
  10.0

反应信息

• 作为产物：
  描述：

  3-diazo-4,5-diphenylpyrazolo<3,4-c>pyridazine 在 盐酸 、 tin(ll) chloride 作用下， 以 乙醇 、 水 为溶剂， 反应 10.0h， 生成 1-(4,5-diphenyl-1H-pyrazolo[3,4-c]pyridazin-3-yl)-4-((4-methoxyphenyl)diazenyl)-1H-pyrazole-3,5-diamine
  参考文献：
  名称：

  Pyridazine derivatives and related compounds. 23*. Synthesis of 3-substituted pyrazolo[3,4-c]pyridazines and their application as disperse dyes

  摘要：

  Acetylacetone and malononitrile were coupled with diazotized arylamines to give arylazoacetyl-acetones and arylazomalononitriles. When refluxed with 3-hydrazino-4,5-diphenyl-1H-pyrazolo-[3,4-c]pyridazine in the presence of ethanol/HCl, they yielded the corresponding 3-[4-(arylazo)-3,5-di-methylpyrazol-1-yl]- and 3-[3,5-diamino-4-(arylazo)pyrazol-1-yl]-4,5-diphenyl-1H-pyrazolo[3,4-c]pyri-dazine dyes. The dyes were applied to polyester and polyamide fabrics, and their spectral and fastness properties were measured.

  DOI：

  10.1007/s10593-010-0494-1