N-cyclohexyl-1-D-ribofuranosyl-1H-pyrazolo<3,4-d>pyrimidin-4-amine | 86954-42-9

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 吡唑并[3，4-d]嘧啶糖苷
• 英文名称: N-cyclohexyl-1-D-ribofuranosyl-1H-pyrazolo<3,4-d>pyrimidin-4-amine
• 英文别名: N-cyclohexyl-1-D-ribofuranosyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine；(3R,4S,5R)-2-[4-(cyclohexylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol
• CAS: 86954-42-9
• 化学式: C₁₆H₂₃N₅O₄
• 分子量: 349.39
• InChiKey: FKRWIATUNQWWIT-QMCPWEQMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  126
• 氢给体数：
  4
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  N-cyclohexyl-1-(2,3,5-tri-O-acetyl-D-ribofuranosyl)pyrazolo<3,4-d>pyrimidin-4-amine 在 sodium methylate 作用下， 以 甲醇 为溶剂， 反应 0.5h， 以99%的产率得到N-cyclohexyl-1-D-ribofuranosyl-1H-pyrazolo<3,4-d>pyrimidin-4-amine
  参考文献：
  名称：

  C4-Substituted 1-.beta.-D-ribofuranosylpyrazolo[3,4-d]pyrimidines as adenosine agonist analogs

  摘要：

  The synthesis of four novel C4-substituted 1-beta-D-ribofuranosylpyrazolo[3,4-d]pyrimidines is reported, and the compounds were examined as adenosine receptor agonist analogues. Neither receptor affinity nor biological activity was as potent as the purine counterparts. Adenosine agonists appear to be sensitive to modification of the purine base, with a nitrogen atom in the 7 position necessary for efficacy.

  DOI：

  10.1021/jm00365a010

文献信息

• C4-Substituted 1-.beta.-D-ribofuranosylpyrazolo[3,4-d]pyrimidines as adenosine agonist analogs
  作者：Harriet W. Hamilton、James A. Bristol

  DOI：10.1021/jm00365a010

  日期：1983.11

  The synthesis of four novel C4-substituted 1-beta-D-ribofuranosylpyrazolo[3,4-d]pyrimidines is reported, and the compounds were examined as adenosine receptor agonist analogues. Neither receptor affinity nor biological activity was as potent as the purine counterparts. Adenosine agonists appear to be sensitive to modification of the purine base, with a nitrogen atom in the 7 position necessary for efficacy.