1-{5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-hydroxy-tetrahydro-furan-2-yl}-4-[(furan-2-ylmethyl)-amino]-1H-pyrimidin-2-one | 271790-79-5

• 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: 1-{5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-hydroxy-tetrahydro-furan-2-yl}-4-[(furan-2-ylmethyl)-amino]-1H-pyrimidin-2-one
• CAS: 271790-79-5
• 化学式: C₃₅H₃₅N₃O₇
• 分子量: 609.679
• InChiKey: GUKDTTUBHGFHAU-RKKDRKJOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.12
• 重原子数：
  45.0
• 可旋转键数：
  12.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  117.21
• 氢给体数：
  2.0
• 氢受体数：
  10.0

反应信息

• 作为反应物：
  描述：

  1-{5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-hydroxy-tetrahydro-furan-2-yl}-4-[(furan-2-ylmethyl)-amino]-1H-pyrimidin-2-one 、 alkaline earth salt of/the/ methylsulfuric acid 生成
  参考文献：
  名称：

  THE SYNTHESIS OF DIENE-CONTAINING NUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE IN THE LABELING OF OLIGONUCLEOTIDES

  摘要：

  A variety of furan-modified nucleoside phosphoramidite monomers has been prepared and efficiently incorporated into oligonucleotides. These take part in Diels-Alder reactions with fluorescent maleimides to give fluorescent-labeled oligonucleotides. This represents a strategy for oligonucleotide labeling that is orthogonal to amine-based methods.

  DOI：

  10.1081/ncn-200060085
• 作为产物：
  描述：

  2-呋喃甲胺 在 hydrogen sulfite 吡啶 作用下， 生成 1-{5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-hydroxy-tetrahydro-furan-2-yl}-4-[(furan-2-ylmethyl)-amino]-1H-pyrimidin-2-one
  参考文献：
  名称：

  THE SYNTHESIS OF DIENE-CONTAINING NUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE IN THE LABELING OF OLIGONUCLEOTIDES

  摘要：

  A variety of furan-modified nucleoside phosphoramidite monomers has been prepared and efficiently incorporated into oligonucleotides. These take part in Diels-Alder reactions with fluorescent maleimides to give fluorescent-labeled oligonucleotides. This represents a strategy for oligonucleotide labeling that is orthogonal to amine-based methods.

  DOI：

  10.1081/ncn-200060085