6-amino-1-methylpyrido-<2,3-d>pyrimidine-2,4-dione | 142168-90-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶并嘧啶类
• 英文名称: 6-amino-1-methylpyrido-<2,3-d>pyrimidine-2,4-dione
• 英文别名: 6-amino-1-methylpyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione；6-amino-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
• CAS: 142168-90-9
• 化学式: C₈H₈N₄O₂
• mdl: MFCD11918015
• 分子量: 192.177
• InChiKey: BSYOOWXZWXXVRN-UHFFFAOYSA-N

物化性质

• 密度：
  1.457±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -0.8
• 重原子数：
  14
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.125
• 拓扑面积：
  88.3
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6-amino-1-methylpyrido-<2,3-d>pyrimidine-2,4-dione 在 溶剂黄146 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 18.75h， 生成 6-formylamino-1-methylpyrido<2,3-d>pyrimidine-2,4-dione
  参考文献：
  名称：

  Ptrimides, XXXII: Synthesis and Properties of Pyrido[2,3-d]pyrimidine-2,4-diones (5-Deazalumazines)

  摘要：

  DOI：

  10.3987/com-91-s100
• 作为产物：
  描述：

  6-氨基-1-甲基尿嘧啶 在 三甲基氯硅烷 、 palladium 10% on activated carbon 、 氢气 作用下， 以 甲醇 、 N,N-二甲基甲酰胺 为溶剂， 20.0~100.0 ℃ 、101.33 kPa 条件下， 生成 6-amino-1-methylpyrido-<2,3-d>pyrimidine-2,4-dione
  参考文献：
  名称：

  Design, synthesis and transformation of some heteroannulated 3-aminopyridines—purine isosteres with exocyclic nitrogen atom

  摘要：

  The synthesis of 1-deazapurines and isosteres bearing the exocyclic nitrogen atom at position-1 was developed basing on the formal [3+3]-cyclization reaction of nitro-malonaldehyde with the set of electron-excessive aminoheterocycles. Through the functionalization of the purine-like scaffolds synthesized the diversity of compounds furnished in the possition-1 with aryl, alkinyl, and vinyl rests, were obtained. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2012.11.026

文献信息

• Design, synthesis and transformation of some heteroannulated 3-aminopyridines—purine isosteres with exocyclic nitrogen atom
  作者：Viktor O. Iaroshenko、Marcelo Vilches-Herrera、Ashot Gevorgyan、Satenik Mkrtchyan、Knar Arakelyan、Dmytro Ostrovskyi、Muhammad S.A. Abbasi、Linda Supe、Ani Hakobyan、Alexander Villinger、Dmitriy M. Volochnyuk、Andrei Tolmachev

  DOI：10.1016/j.tet.2012.11.026

  日期：2013.1

  The synthesis of 1-deazapurines and isosteres bearing the exocyclic nitrogen atom at position-1 was developed basing on the formal [3+3]-cyclization reaction of nitro-malonaldehyde with the set of electron-excessive aminoheterocycles. Through the functionalization of the purine-like scaffolds synthesized the diversity of compounds furnished in the possition-1 with aryl, alkinyl, and vinyl rests, were obtained. (C) 2012 Elsevier Ltd. All rights reserved.
• Ptrimides, XXXII: Synthesis and Properties of Pyrido[2,3-d]pyrimidine-2,4-diones (5-Deazalumazines)
  作者：Wolfgang Pfleiderer、Mathias Pfleiderer、Wolfgang Pfleiderer

  DOI：10.3987/com-91-s100

  日期：——