N-[3-[(2R,3R,4R,5R)-5-[Bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-ylsulfanylmethyl]-5-(2,2,2-trifluoro-acetylamino)-pentyl]-2,2,2-trifluoro-acetamide | 607390-57-8

• 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: N-[3-[(2R,3R,4R,5R)-5-[Bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-ylsulfanylmethyl]-5-(2,2,2-trifluoro-acetylamino)-pentyl]-2,2,2-trifluoro-acetamide
• CAS: 607390-57-8
• 化学式: C₄₀H₄₂F₆N₄O₉S
• 分子量: 868.851
• InChiKey: FQQWEARKCCFNSI-DWNQJFHRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.68
• 重原子数：
  60.0
• 可旋转键数：
  18.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  170.21
• 氢给体数：
  4.0
• 氢受体数：
  11.0

反应信息

• 作为反应物：
  描述：

  2-氰乙基N,N-二异丙基氯亚磷酰胺 、 N-[3-[(2R,3R,4R,5R)-5-[Bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-ylsulfanylmethyl]-5-(2,2,2-trifluoro-acetylamino)-pentyl]-2,2,2-trifluoro-acetamide 在 4-二甲氨基吡啶 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 0.5h， 生成 N-[3-[[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxy-2-(2,4-dioxopyrimidin-1-yl)oxolan-3-yl]sulfanylmethyl]-5-[(2,2,2-trifluoroacetyl)amino]pentyl]-2,2,2-trifluoroacetamide
  参考文献：
  名称：

  Nylon/DNA:  Single-Stranded DNA with a Covalently Stitched Nylon Lining

  摘要：

  The synthesis of DNA/nylon ladder oligomers is described. Three stages of the development are addressed: the synthesis of 2'-beta-substituted phosphoramidites, the deprotection/purification protocols of ODNs modified with both amino and carboxyl groups, and amide bond-forming reactions on the ODNs. The established technology and the novel DNA-based ladder oligomer structure opens a pathway to the synthesis of topological molecular objects and networks templated by DNA through versatile DNA nanotechnology. The DNA-based ladder oligomers may find application in the antisense area.

  DOI：

  10.1021/ja035186r
• 作为产物：
  描述：

  在 吡啶 、 三乙胺 、 肼 作用下， 以 甲醇 为溶剂， 反应 21.0h， 生成 N-[3-[(2R,3R,4R,5R)-5-[Bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-ylsulfanylmethyl]-5-(2,2,2-trifluoro-acetylamino)-pentyl]-2,2,2-trifluoro-acetamide
  参考文献：
  名称：

  Nylon/DNA:  Single-Stranded DNA with a Covalently Stitched Nylon Lining

  摘要：

  The synthesis of DNA/nylon ladder oligomers is described. Three stages of the development are addressed: the synthesis of 2'-beta-substituted phosphoramidites, the deprotection/purification protocols of ODNs modified with both amino and carboxyl groups, and amide bond-forming reactions on the ODNs. The established technology and the novel DNA-based ladder oligomer structure opens a pathway to the synthesis of topological molecular objects and networks templated by DNA through versatile DNA nanotechnology. The DNA-based ladder oligomers may find application in the antisense area.

  DOI：

  10.1021/ja035186r