4-[3-Methyl-6-[[methyl(phenyl)hydrazinylidene]methyl]-2-oxopyrimidin-3-ium-1-yl]butane-1-sulfonic acid

• 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-[3-Methyl-6-[[methyl(phenyl)hydrazinylidene]methyl]-2-oxopyrimidin-3-ium-1-yl]butane-1-sulfonic acid
• 英文别名: 4-[3-methyl-6-[[methyl(phenyl)hydrazinylidene]methyl]-2-oxopyrimidin-3-ium-1-yl]butane-1-sulfonic acid
• 化学式: C17H23N4O4S+
• 分子量: 379.5
• InChiKey: YQCFBLHGEKMRTG-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  26
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  102
• 氢给体数：
  1
• 氢受体数：
  6

文献信息

• Agents for colouring keratin fibres comprising zwitterionic azomethine dyes
  申请人：The Procter & Gamble Company

  公开号：EP1847250B1

  公开（公告）日：2009-12-23
• Agents for coloring keratin fibers comprising zwitterionic azomethine dyes
  申请人：Pasquier Cecile

  公开号：US20070245501A1

  公开（公告）日：2007-10-25

  The present invention relates to agents for coloring keratin fibers which comprise at least one zwitterionic azomethine dye of the general formula (I), (II), or (III) in which z is a heterocycle of the formula in which R8 is an alkyl sulfonate radical of the formula (XIII);
• US7513918B2
  申请人：——

  公开号：US7513918B2

  公开（公告）日：2009-04-07
• [EN] AGENTS FOR COLOURING KERATIN FIBRES COMPRISING ZWITTERIONIC AZOMETHINE DYES<br/>[FR] AGENTS DE COLORATION DE FIBRES DE KÉRATINE COMPRENANT DES COLORANTS AZOMÉTHINE ZWITTERIONIQUES
  申请人：PROCTER & GAMBLE

  公开号：WO2007119228A2

  公开（公告）日：2007-10-25

  [EN] The present invention relates to agents for colouring keratin fibres which comprise at least one zwitterionic azomethine dye of the general formula (I), (II) or (III) in which z is a heterocycle of the formula (IV), (V), (VI), (VII), (VIII), (IX), (X), (XI), (XII) in which R8 is an alkyl sulfonate radical of the formula (XIII);
  [FR] La présente invention porte sur des agents de coloration de fibres de kératine qui comprennent au moins un colorant azométhine zwitterionique de formule générale (I), (II) ou (III) dans laquelle z est un hétérocycle de formule (IV), (V), (VI), (VII), (VIII), (IX), (X), (XI), (XII) dans laquelle R8 est un radical sulfonate d'alkyle de formule (XIII).