5-(benzyloxycarbonyl)amino-1-(5-O-dimethoxytrityl-2-deoxy-β-D-ribofuranosyl)imidazole-4-carboxamide | 170871-08-6

• 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: 5-(benzyloxycarbonyl)amino-1-(5-O-dimethoxytrityl-2-deoxy-β-D-ribofuranosyl)imidazole-4-carboxamide
• 英文别名: benzyl N-[3-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-5-carbamoylimidazol-4-yl]carbamate
• CAS: 170871-08-6
• 化学式: C₃₈H₃₈N₄O₈
• 分子量: 678.742
• InChiKey: XAKWOUPAJHXAEH-WIHCDAFUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.41
• 重原子数：
  50.0
• 可旋转键数：
  13.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  156.39
• 氢给体数：
  3.0
• 氢受体数：
  10.0

反应信息

• 作为反应物：
  描述：

  5-(benzyloxycarbonyl)amino-1-(5-O-dimethoxytrityl-2-deoxy-β-D-ribofuranosyl)imidazole-4-carboxamide 在 三乙胺 作用下， 以 吡啶 、 水 为溶剂， 反应 5.58h， 生成 (3-{(2R,4S,5R)-5-[Bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-[(2-chloro-phenoxy)-hydroxy-phosphoryloxy]-tetrahydro-furan-2-yl}-5-carbamoyl-3H-imidazol-4-yl)-carbamic acid benzyl ester
  参考文献：
  名称：

  Oligodeoxynucleotides Embodying the Ambiguous Base Z, 5-Amino-imidazole-4-carboxamide

  摘要：

  Short oligomers containing 5-amino-1-(2-deoxy-beta-D-ribofuranosyl)imidazole-4-carboxamide (dZ) were synthesized in solution using the phosphotriester methodology. Usual acyl groups were used for the canonical bases. For the exocyclic amino function of Z residue, the hydrogenolyzable benzyloxycarbonyl group was introduced

  DOI：

  10.1080/15257779508010683
• 作为产物：
  描述：

  5-amino-1-(2-deoxy-3,5-di-O-tert-butyldimethylsilyl-β-D-ribofuranosyl)imidazole-4-carboxamide 在 四丁基氟化铵 作用下， 以 四氢呋喃 、 吡啶 、 二氯甲烷 为溶剂， 反应 2.33h， 生成 5-(benzyloxycarbonyl)amino-1-(5-O-dimethoxytrityl-2-deoxy-β-D-ribofuranosyl)imidazole-4-carboxamide
  参考文献：
  名称：

  Oligodeoxynucleotides Embodying the Ambiguous Base Z, 5-Amino-imidazole-4-carboxamide

  摘要：

  Short oligomers containing 5-amino-1-(2-deoxy-beta-D-ribofuranosyl)imidazole-4-carboxamide (dZ) were synthesized in solution using the phosphotriester methodology. Usual acyl groups were used for the canonical bases. For the exocyclic amino function of Z residue, the hydrogenolyzable benzyloxycarbonyl group was introduced

  DOI：

  10.1080/15257779508010683