(E)-6-(pyrrolidin-1-yl)-8-(4-(trifluoromethyl)styryl)-9H-purine | 1585984-90-2

• 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: (E)-6-(pyrrolidin-1-yl)-8-(4-(trifluoromethyl)styryl)-9H-purine
• 英文别名: 6-pyrrolidin-1-yl-8-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]-7H-purine
• CAS: 1585984-90-2
• 化学式: C₁₈H₁₆F₃N₅
• 分子量: 359.354
• InChiKey: AWMMYEYJSFTPJN-VMPITWQZSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  57.7
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  (E)-6-chloro-9-(tetrahydro-2H-pyran-2-yl)-8-(4-(trifluoromethyl)styryl)-9H-purine 在 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 生成 (E)-6-(pyrrolidin-1-yl)-8-(4-(trifluoromethyl)styryl)-9H-purine
  参考文献：
  名称：

  Synthesis and evaluation of spectroscopic properties of newly synthesized push–pull 6-amino-8-styryl purines

  摘要：

  New 6-amino-8-styryl purines were synthesized using direct C H bond functionalization. These push pull compounds showed strong fluorescence, high quantum yields and a noteworthy fluorosolvatochromism. Deprotected purines 7a-c are promising targets for incorporation into nucleic acids as they are still fluorescent in aqueous media. (c) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2014.01.025

文献信息

• Synthesis and evaluation of spectroscopic properties of newly synthesized push–pull 6-amino-8-styryl purines
  作者：Roxane Vabre、Michel Legraverend、Sandrine Piguel

  DOI：10.1016/j.dyepig.2014.01.025

  日期：2014.6

  New 6-amino-8-styryl purines were synthesized using direct C H bond functionalization. These push pull compounds showed strong fluorescence, high quantum yields and a noteworthy fluorosolvatochromism. Deprotected purines 7a-c are promising targets for incorporation into nucleic acids as they are still fluorescent in aqueous media. (c) 2014 Elsevier Ltd. All rights reserved.