5-[2,2']Bithiophenyl-5-yl-1-((2R,4S,5R)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidine-2,4-dione | 169687-86-9

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 嘧啶核苷
• 英文名称: 5-[2,2']Bithiophenyl-5-yl-1-((2R,4S,5R)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidine-2,4-dione
• 英文别名: 5-[2,2'-Bithiophen]-5-yl-2'-deoxyuridine；1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(5-thiophen-2-ylthiophen-2-yl)pyrimidine-2,4-dione
• CAS: 169687-86-9
• 化学式: C₁₇H₁₆N₂O₅S₂
• 分子量: 392.456
• InChiKey: DRTMBLLJKIRSGI-FIXISWKDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  156
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  2-三丁基甲锡烷基噻吩 、 5-(5-bromothien-2-yl)-1-(β-D-2-deoxyribofuranos-1-yl)uracil 在 palladium diacetate 、 三苯胂 、 三乙胺 作用下， 生成 5-[2,2']Bithiophenyl-5-yl-1-((2R,4S,5R)-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidine-2,4-dione
  参考文献：
  名称：

  Synthesis and Antiviral Activities of Some New 5-Heteroaromatic Substituted Derivatives of 2'-Deoxyuridine

  摘要：

  Eight new 5-heteroaromatic substituted analogues of 2'-deoxyuridine have been synthesized and evaluated for their inhibitory properties against a panel of different viruses. Several analogues containing a substituted thiophene moiety proved to be highly selective against herpes simplex virus type 1 (HSV-1).

  DOI：

  10.1080/15257779508012418

文献信息

• Synthesis and Antiviral Activities of Some New 5-Heteroaromatic Substituted Derivatives of 2'-Deoxyuridine
  作者：J. Liu、A. Van Aerschot、I. Luyten、P. Wigerinck、C. Pannecouque、J. Balzarini、E. De Clercq、P. Herdewijn

  DOI：10.1080/15257779508012418

  日期：1995.5.1

  Eight new 5-heteroaromatic substituted analogues of 2'-deoxyuridine have been synthesized and evaluated for their inhibitory properties against a panel of different viruses. Several analogues containing a substituted thiophene moiety proved to be highly selective against herpes simplex virus type 1 (HSV-1).