| 246023-99-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• CAS: 246023-99-4
• 化学式: C₃₉H₃₉N₃O₁₁S
• 分子量: 757.818
• InChiKey: DIVTYEOAGWJGBA-BMPTZRATSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.71
• 重原子数：
  54.0
• 可旋转键数：
  14.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  173.48
• 氢给体数：
  2.0
• 氢受体数：
  12.0

反应信息

• 作为反应物：
  描述：

  在 palladium on activated charcoal 四丁基氟化铵 、 氢气 、 N,N-二异丙基乙胺 作用下， 生成 [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] N-[(2S,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolane-2-carbonyl]sulfamate
  参考文献：
  名称：

  Synthesis of a N-acylsulfamide linked dinucleoside and its incorporation into an oligonucleotide

  摘要：

  A N-acylsulfamide linked thymidine dinucleoside was synthesized and incorporated into an oligonucleotide (ON). The interest is in a linkage analog that has a higher pKa relative to a phosphodiester and when incorporated into ONs is capable of helix formation with complementary RNA. The hybridization property of the resultant ON with RNA was shown to result in significant destabilization. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(99)00358-3
• 作为产物：
  描述：

  苯甲醇 、 alkaline earth salt of/the/ methylsulfuric acid 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Synthesis of a N-acylsulfamide linked dinucleoside and its incorporation into an oligonucleotide

  摘要：

  A N-acylsulfamide linked thymidine dinucleoside was synthesized and incorporated into an oligonucleotide (ON). The interest is in a linkage analog that has a higher pKa relative to a phosphodiester and when incorporated into ONs is capable of helix formation with complementary RNA. The hybridization property of the resultant ON with RNA was shown to result in significant destabilization. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(99)00358-3