1-(2-deoxy-3-methanesulfonyl-5-O-triphenylmethyl-β-D-erythro-pentofuranosyl)thieno<3,2-d>pyrimidine-2,4-dione | 160234-50-4

• 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: 1-(2-deoxy-3-methanesulfonyl-5-O-triphenylmethyl-β-D-erythro-pentofuranosyl)thieno<3,2-d>pyrimidine-2,4-dione
• CAS: 160234-50-4
• 化学式: C₃₁H₂₈N₂O₇S₂
• 分子量: 604.705
• InChiKey: JTTYAKZYEDKDRK-OYUWMTPXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.39
• 重原子数：
  42.0
• 可旋转键数：
  9.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  116.69
• 氢给体数：
  1.0
• 氢受体数：
  9.0

反应信息

• 作为反应物：
  描述：

  1-(2-deoxy-3-methanesulfonyl-5-O-triphenylmethyl-β-D-erythro-pentofuranosyl)thieno<3,2-d>pyrimidine-2,4-dione 在 sodium hydroxide 、 溶剂黄146 作用下， 以 乙醇 为溶剂， 反应 42.0h， 生成 1-(2-deoxy-β-D-threo-pentofuranosyl)thieno<3,2-d>pyrimidine-2,4-dione
  参考文献：
  名称：

  Synthesis of N-1β-D-Arabinofuranosyl and N-1-2′-Deoxy-β-D-erythro-pentofuranosyl Thieno [3,2-d] Pyrimidine Nucleosides

  摘要：

  Synthetic methods for 1-(beta-D-arabinofuranosyl) and 1(2-deoxy-beta-D-erythro-pentofuranosyl)thieno[3,2-d]pyrimidine-2,4-diones from the corresponding 1-(beta-D-ribofuranosyl) nucleoside have been developed in this report. These compounds were tested against HIV-1 in CEM cl 13 cell cultures, but none df them exhibited significant inhibitory activity against this virus.

  DOI：

  10.1080/15257779408011866
• 作为产物：
  描述：

  1-(2-deoxy-3,5-di-O-acetyl-β-D-erythro-pentofuranosyl)thieno<3,2-d>pyrimidine-2,4-dione 在 氨 作用下， 以 吡啶 、 甲醇 为溶剂， 反应 124.0h， 生成 1-(2-deoxy-3-methanesulfonyl-5-O-triphenylmethyl-β-D-erythro-pentofuranosyl)thieno<3,2-d>pyrimidine-2,4-dione
  参考文献：
  名称：

  Synthesis of N-1β-D-Arabinofuranosyl and N-1-2′-Deoxy-β-D-erythro-pentofuranosyl Thieno [3,2-d] Pyrimidine Nucleosides

  摘要：

  Synthetic methods for 1-(beta-D-arabinofuranosyl) and 1(2-deoxy-beta-D-erythro-pentofuranosyl)thieno[3,2-d]pyrimidine-2,4-diones from the corresponding 1-(beta-D-ribofuranosyl) nucleoside have been developed in this report. These compounds were tested against HIV-1 in CEM cl 13 cell cultures, but none df them exhibited significant inhibitory activity against this virus.

  DOI：

  10.1080/15257779408011866