| 206440-52-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• CAS: 206440-52-0
• 化学式: C₁₅H₁₆Cl₂N₄O₆
• 分子量: 419.221
• InChiKey: AIMVMIPJRZGWES-RMPHRYRLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.1
• 重原子数：
  27.0
• 可旋转键数：
  5.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  150.08
• 氢给体数：
  5.0
• 氢受体数：
  10.0

反应信息

• 作为反应物：
  描述：

  在 N,N-二异丙基乙胺 作用下， 以 水 、 二甲基亚砜 、 乙腈 为溶剂， 反应 2.0h， 生成
  参考文献：
  名称：

  Incorporation of carbohydrates and peptides into large triazine-based screening libraries using automated parallel synthesis

  摘要：

  A procedure for the sequential, selective derivatization of cyanuric chloride that allows for the incorporation of carbohydrates and peptides has been elucidated. As a result, large combinatorial arrays of individual derivatives, over 40,000 in all, have been produced in 50 mu mole quantities using automated parallel solution phase synthesis. The use of this technology in a search for protease inhibitors, glycopeptide surrogates and other bioactive compound classes will also be discussed. (C) 1998 Published by Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(98)00134-3
• 作为产物：
  描述：

  4-硝基苯-Β-D-吡喃葡萄糖苷 在 palladium on activated charcoal 氢气 、 N,N-二异丙基乙胺 作用下， 以 二甲基亚砜 、 乙腈 为溶剂， 反应 1.0h， 生成
  参考文献：
  名称：

  Incorporation of carbohydrates and peptides into large triazine-based screening libraries using automated parallel synthesis

  摘要：

  A procedure for the sequential, selective derivatization of cyanuric chloride that allows for the incorporation of carbohydrates and peptides has been elucidated. As a result, large combinatorial arrays of individual derivatives, over 40,000 in all, have been produced in 50 mu mole quantities using automated parallel solution phase synthesis. The use of this technology in a search for protease inhibitors, glycopeptide surrogates and other bioactive compound classes will also be discussed. (C) 1998 Published by Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(98)00134-3