2'-deoxyadenosine-5'-iminodiacetyl phosphoramide | 1234570-04-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并嘧啶类
• 英文名称: 2'-deoxyadenosine-5'-iminodiacetyl phosphoramide
• 英文别名: IDA-dAMP；2-[[[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]-(carboxymethyl)amino]acetic acid
• CAS: 1234570-04-7
• 化学式: C₁₄H₁₉N₆O₉P
• 分子量: 446.313
• InChiKey: SXPDXCYUNNCMNL-DJLDLDEBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.3
• 重原子数：
  30
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  223
• 氢给体数：
  5
• 氢受体数：
  14

文献信息

• NOVEL PHOSPHATE MODIFIED NUCLEOSIDES USEFUL AS SUBSTRATES FOR POLYMERASES AND AS ANTIVIRAL AGENTS
  申请人：Herdewijn Piet

  公开号：US20120108533A1

  公开（公告）日：2012-05-03

  This invention provides phosphate-modified nucleosides represented by the structural formula: wherein W is O or S, and wherein B, R 1 ; R 3 and R 2 . are s defined herein. These compounds are useful as substrates for DNA/RNA polymerases, and as anti-viral agents in particular against HIV-1.