[9-((2S,3S,5R)-3-Amino-5-trityloxymethyl-tetrahydro-furan-2-yl)-9H-purin-6-yl]-trityl-amine | 216571-42-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• 英文名称: [9-((2S,3S,5R)-3-Amino-5-trityloxymethyl-tetrahydro-furan-2-yl)-9H-purin-6-yl]-trityl-amine
• 英文别名: 9-[(2S,3S,5R)-3-amino-5-(trityloxymethyl)oxolan-2-yl]-N-tritylpurin-6-amine
• CAS: 216571-42-5
• 化学式: C₄₈H₄₂N₆O₂
• 分子量: 734.9
• InChiKey: XPWFNORHMZREOU-HMEZMJIUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.85
• 重原子数：
  56.0
• 可旋转键数：
  12.0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  100.11
• 氢给体数：
  2.0
• 氢受体数：
  8.0

反应信息

• 作为反应物：
  描述：

  [9-((2S,3S,5R)-3-Amino-5-trityloxymethyl-tetrahydro-furan-2-yl)-9H-purin-6-yl]-trityl-amine 在 溶剂黄146 作用下， 以 水 为溶剂， 以75%的产率得到[(2R,4S,5S)-4-Amino-5-(6-amino-purin-9-yl)-tetrahydro-furan-2-yl]-methanol
  参考文献：
  名称：

  Unnatural β-L-Enantiomers of Nucleoside Analogues as Potent Anti-Hepatitis B Virus Agents

  摘要：

  Several 2'- or 3'-substituted 2',3'-dideoxy-beta-L-nucleosides bearing adenine as the base were stereospecifically synthesized and their antiviral properties examined. Two of them, namely 2'-azido- and 3'-azido-2',3'-dideoxy-beta-L-adenosine (2'-N-3-beta-L-ddA and 3'-N-3-beta-L-ddA) were found to have some anti-hepatitis B virus (HBV) activity in cell culture.

  DOI：

  10.1080/07328319808004708
• 作为产物：
  描述：

  [(2R,4S,5S)-4-acetyloxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methyl benzoate 在 吡啶 、 甲醇 、 ammonium hydroxide 、 二苯基磷酸 、 氨 、 sodium methylate 、 三苯基膦 、 偶氮二甲酸二乙酯 作用下， 以 四氢呋喃 为溶剂， 生成 [9-((2S,3S,5R)-3-Amino-5-trityloxymethyl-tetrahydro-furan-2-yl)-9H-purin-6-yl]-trityl-amine
  参考文献：
  名称：

  Unnatural β-L-Enantiomers of Nucleoside Analogues as Potent Anti-Hepatitis B Virus Agents

  摘要：

  Several 2'- or 3'-substituted 2',3'-dideoxy-beta-L-nucleosides bearing adenine as the base were stereospecifically synthesized and their antiviral properties examined. Two of them, namely 2'-azido- and 3'-azido-2',3'-dideoxy-beta-L-adenosine (2'-N-3-beta-L-ddA and 3'-N-3-beta-L-ddA) were found to have some anti-hepatitis B virus (HBV) activity in cell culture.

  DOI：

  10.1080/07328319808004708