N-[6-[[(2,4-dinitrophenyl)hydrazinylidene]methyl]-4-oxo-3H-pteridin-2-yl]-2,2-dimethylpropanamide | 1597415-25-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 蝶啶及其衍生物
• 英文名称: N-[6-[[(2,4-dinitrophenyl)hydrazinylidene]methyl]-4-oxo-3H-pteridin-2-yl]-2,2-dimethylpropanamide
• CAS: 1597415-25-2
• 化学式: C₁₈H₁₇N₉O₆
• 分子量: 455.39
• InChiKey: HVPNJAKAIKIHQW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  33
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  212
• 氢给体数：
  3
• 氢受体数：
  11

反应信息

• 作为反应物：
  描述：

  N-[6-[[(2,4-dinitrophenyl)hydrazinylidene]methyl]-4-oxo-3H-pteridin-2-yl]-2,2-dimethylpropanamide 、 四丁基醋酸铵 以 氘代二甲亚砜 为溶剂， 生成
  参考文献：
  名称：

  Pterin-based highly selective, ratiometric, and sensitive ‘naked-eye’ sensor for acetate

  摘要：

  The design and synthesis of a new pterin-based ratiometric and sensitive 'naked-eye' sensor R for highly selective recognition of acetate are reported. The acidic lactam NH and the NH of 2-N-pivaloyl group of receptor R along with 2,4-dinitrophenyl hydrazone group having the other acidic NH moiety lead to the binding of acetate anion in a 1:2 ratio by change of spectroscopic behavior on complexation (UV-vis and H-1 NMR studies) which is also proven by job plot. The sharp color change from light yellow to violet promises R to be a useful chromogenic ratiometric sensor for acetate amongst other common anions. (C) 2014 Elsevier Ltd. All rights reserved,

  DOI：

  10.1016/j.tetlet.2014.03.068
• 作为产物：
  描述：

  N-[6-(dimethoxymethyl)-4-oxo-3H-pteridin-2-yl]-2,2-dimethylpropanamide 在 溶剂黄146 、 三氟乙酸 作用下， 以 乙醇 、 二氯甲烷 为溶剂， 反应 2.0h， 生成 N-[6-[[(2,4-dinitrophenyl)hydrazinylidene]methyl]-4-oxo-3H-pteridin-2-yl]-2,2-dimethylpropanamide
  参考文献：
  名称：

  Pterin-based highly selective, ratiometric, and sensitive ‘naked-eye’ sensor for acetate

  摘要：

  The design and synthesis of a new pterin-based ratiometric and sensitive 'naked-eye' sensor R for highly selective recognition of acetate are reported. The acidic lactam NH and the NH of 2-N-pivaloyl group of receptor R along with 2,4-dinitrophenyl hydrazone group having the other acidic NH moiety lead to the binding of acetate anion in a 1:2 ratio by change of spectroscopic behavior on complexation (UV-vis and H-1 NMR studies) which is also proven by job plot. The sharp color change from light yellow to violet promises R to be a useful chromogenic ratiometric sensor for acetate amongst other common anions. (C) 2014 Elsevier Ltd. All rights reserved,

  DOI：

  10.1016/j.tetlet.2014.03.068