N-[8-((+)-biotinamido)-3,6-dioxaoctyl]-2-[[2-phenyl-1-thioxo]thio]propanamide | 881212-59-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 生物素及其衍生物
• 英文名称: N-[8-((+)-biotinamido)-3,6-dioxaoctyl]-2-[[2-phenyl-1-thioxo]thio]propanamide
• 英文别名: [1-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethylamino]-1-oxopropan-2-yl] benzenecarbodithioate
• CAS: 881212-59-5
• 化学式: C₂₆H₃₈N₄O₅S₃
• 分子量: 582.81
• InChiKey: JNDRRKUCEMXTQK-ASTRMCFDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  38
• 可旋转键数：
  18
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  201
• 氢给体数：
  4
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  2-(硫代苯甲酰硫基)丙酸 在 N,N'-二环己基碳二亚胺 作用下， 以 氯仿 为溶剂， 反应 25.0h， 生成 N-[8-((+)-biotinamido)-3,6-dioxaoctyl]-2-[[2-phenyl-1-thioxo]thio]propanamide
  参考文献：
  名称：

  Versatile Precursors of Functional RAFT Agents. Application to the Synthesis of Bio-Related End-Functionalized Polymers

  摘要：

  Biomolecule-polymer conjugates are widely used in bio-related fields, but their synthesis is often tricky, especially the introduction of a single biomolecule at one chain end. This paper describes a new straightforward approach to prepare such conjugates via RAFT polymerization. By designing appropriate bio-related RAFT agents, polymer chains of controlled chain length (Mn = 10 000-40 000 and PDI < 1.1) carrying a single biomolecule as an alpha-end group (a sugar or a biotin) linked by a stable amide bond are obtained. Considering the versatility of the RAFT process, this strategy appears to be very attractive for the design of a variety of conjugates.

  DOI：

  10.1021/ja057481c

文献信息

• Versatile Precursors of Functional RAFT Agents. Application to the Synthesis of Bio-Related End-Functionalized Polymers
  作者：Maël Bathfield、Franck D'Agosto、Roger Spitz、Marie-Thérèse Charreyre、Thierry Delair

  DOI：10.1021/ja057481c

  日期：2006.3.1

  Biomolecule-polymer conjugates are widely used in bio-related fields, but their synthesis is often tricky, especially the introduction of a single biomolecule at one chain end. This paper describes a new straightforward approach to prepare such conjugates via RAFT polymerization. By designing appropriate bio-related RAFT agents, polymer chains of controlled chain length (Mn = 10 000-40 000 and PDI < 1.1) carrying a single biomolecule as an alpha-end group (a sugar or a biotin) linked by a stable amide bond are obtained. Considering the versatility of the RAFT process, this strategy appears to be very attractive for the design of a variety of conjugates.