acide (hydroxy-2 ethyl)-5 phenyl-5 barbiturique | 98793-61-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: acide (hydroxy-2 ethyl)-5 phenyl-5 barbiturique
• 英文别名: 5-(2-hydroxy-ethyl)-5-phenyl-barbituric acid；5-(2-Hydroxy-aethyl)-5-phenyl-barbitursaeure；5-phenyl-5-hydroxyethyl barbituric acid；2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2-hydroxyethyl)-5-phenyl-；5-(2-hydroxyethyl)-5-phenyl-1,3-diazinane-2,4,6-trione
• CAS: 98793-61-4
• 化学式: C₁₂H₁₂N₂O₄
• 分子量: 248.238
• InChiKey: MBKHGECZFQWLRD-UHFFFAOYSA-N

物化性质

• 密度：
  1.336±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.2
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  95.5
• 氢给体数：
  3
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  acide (hydroxy-2 ethyl)-5 phenyl-5 barbiturique 在 buffer (citric acid - disodium phosphate) 作用下， 反应 10.0h， 以100%的产率得到4,5-二氢-3-苯基-2-呋喃酮
  参考文献：
  名称：

  Cave; Lafont; Menager, European Journal of Medicinal Chemistry, 1986, vol. 21, # 6, p. 487 - 492

  摘要：

  DOI：
• 作为产物：
  描述：

  (2-vinyloxy-ethyl)-phenyl-malonic acid diethyl ester 、 尿素 在 sodium ethanolate 作用下， 生成 acide (hydroxy-2 ethyl)-5 phenyl-5 barbiturique
  参考文献：
  名称：

  Nelson; Cretcher, Journal of the American Chemical Society, 1928, vol. 50, p. 2761

  摘要：

  DOI：

文献信息

• Ligand detection method and substituted carboxyfluorescein tracers therefor
  申请人：ABBOTT LABORATORIES

  公开号：EP0218010A2

  公开（公告）日：1987-04-15

  This disclosure relates to a method and reagents for determining ligands in biological fluids such as serum, plasma, spinal fluid, amnionic fluid and urine. This disclosure also relates to a novel class of tracer compounds employed as reagents in fluorescence polarization immunoassays.

  本公开涉及一种测定血清、血浆、脊髓液、羊膜液和尿液等生物液体中配体的方法和试剂。本公开还涉及在荧光偏振免疫分析中用作试剂的一类新型示踪化合物。
• Barbiturate assay, tracers, immunogens and antibodies
  申请人：ABBOTT LABORATORIES

  公开号：EP0373508A2

  公开（公告）日：1990-06-20

  The present invention is directed to a fluorescence polarization immunoassay for barbiturates, to the various components needed for preparing and carrying out such an assay, and to methods of making these components. Specifically, tracers, immunogens and antibodies are disclosed, as well as methods for preparing them. The tracers and the immunogens are made from substituted barbiturate compounds. A fluorescein moiety is included in the tracer, while a poly(amino acid) forms a part of the immunogen. The assay is conducted by measuring the degree of polarization retention of plane-polarized light that has been passed through a sample containing antiserum and tracer.

  本发明涉及巴比妥类药物的荧光偏振免疫分析法、制备和进行这种分析法所需的各种成分以及制造这些成分的方法。具体而言，本发明公开了示踪剂、免疫原和抗体，以及制备它们的方法。示踪剂和免疫原由取代的巴比妥酸盐化合物制成。示踪剂中含有荧光素分子，免疫原中含有聚氨基酸分子。检测方法是测量平面偏振光通过含有抗血清和示踪剂的样品时的偏振保留程度。
• Barbiturate assay, tracers, immunogens, antibodies and kit
  申请人：ABBOTT LABORATORIES

  公开号：EP0457213B1

  公开（公告）日：1997-07-23
• FLENTGE, C. A.;HERRIN, T. R.
  作者：FLENTGE, C. A.、HERRIN, T. R.

  DOI：——

  日期：——
• US6472227B1
  申请人：——

  公开号：US6472227B1

  公开（公告）日：2002-10-29