cis-5'-O-{4-[3-(2-thiophenyl)pyridin-5-yl]-2-oxo-1,3,2-dioxaphosphorin-2-yI}-2'-C-methyladenosine | 926654-25-3

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 嘌呤核苷酸
• 英文名称: cis-5'-O-{4-[3-(2-thiophenyl)pyridin-5-yl]-2-oxo-1,3,2-dioxaphosphorin-2-yI}-2'-C-methyladenosine
• 英文别名: (2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-methyl-5-[[2-oxo-4-(5-thiophen-2-ylpyridin-3-yl)-1,3,2lambda5-dioxaphosphinan-2-yl]oxymethyl]oxolane-3,4-diol；(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-methyl-5-[[2-oxo-4-(5-thiophen-2-ylpyridin-3-yl)-1,3,2λ5-dioxaphosphinan-2-yl]oxymethyl]oxolane-3,4-diol
• CAS: 926654-25-3
• 化学式: C₂₃H₂₅N₆O₇PS
• 分子量: 560.527
• InChiKey: HMOBDNCFRXCXKV-FCTAZGGSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.4
• 重原子数：
  38
• 可旋转键数：
  6
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  205
• 氢给体数：
  3
• 氢受体数：
  13

文献信息

• Novel 2'-c-methyl and 4'c-methyl nucleoside derivatives
  申请人：Erion Mark D.

  公开号：US20090118223A1

  公开（公告）日：2009-05-07

  Novel 2′-C-methyl nucleoside 5′-monophosphate and 4′-C-methyl nucleoside 5′-monophosphate derivatives, stereoisomers, and pharmaceutically acceptable salts or prodrugs thereof, their preparation, and their uses for the treatment of hepatitis C viral infection are described.