2-(benzylsulfanyl)-5-(diphenylmethyl)-6-hydroxypyrimidin-4(3H)-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-(benzylsulfanyl)-5-(diphenylmethyl)-6-hydroxypyrimidin-4(3H)-one
• 英文别名: 5-benzhydryl-2-benzylsulfanyl-4-hydroxy-1H-pyrimidin-6-one
• 化学式: C₂₄H₂₀N₂O₂S
• mdl: MFCD00807919
• 分子量: 400.5
• InChiKey: HHCBYHPBZGSTDQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  87
• 氢给体数：
  2
• 氢受体数：
  4

文献信息

• High throughput screening assay for the TRPM5 ion channel
  申请人：Bryant W. Robert

  公开号：US20070111264A1

  公开（公告）日：2007-05-17

  There exists a need in the art for high throughput screening assays that can identify compounds that specifically modulate the activity of fast-acting ion channels, such as TRPM5. Current methods suffer from a lack of sensitivity, low throughput, and are labor intensive. The claimed methods provide fluorescent assays with an optical readout that gives rapid readout of the results, has a high signal to noise background ratio, are easy to use, can be modified for automation and miniaturization, and provide verification that a compound specifically modulates TRPM5.
• High Throughput Screening Assay for the TRPM5 Ion Channel
  申请人：BRYANT Robert W.

  公开号：US20100248988A1

  公开（公告）日：2010-09-30

  There exists a need in the art for high throughput screening assays that can identify compounds that specifically modulate the activity of fast-acting ion channels, such as TRPM5. Current methods suffer from a lack of sensitivity, low throughput, and are labor intensive. The claimed methods provide fluorescent assays with an optical readout that gives rapid readout of the results, has a high signal to noise background ratio, are easy to use, can be modified for automation and miniaturization, and provide verification that a compound specifically modulates TRPM5.
• US7749730B2
  申请人：——

  公开号：US7749730B2

  公开（公告）日：2010-07-06
• [EN] HIGH THROUGHPUT SCREENING ASSAY FOR THE TRPM5 ION CHANNEL<br/>[FR] ESSAI DE DEPISTAGE A HAUT RENDEMENT POUR LE CANAL IONIQUE TRPM5
  申请人：REDPOINT BIO CORP

  公开号：WO2007056160A2

  公开（公告）日：2007-05-18

  [EN] There exists a need in the art for high throughput screening assays that can identify compounds that specifically modulate the activity of fast-acting ion channels, such as TRPM5. Current methods suffer from a lack of sensitivity, low throughput, and are labor intensive. The claimed methods provide fluorescent assays with an optical readout that gives rapid readout of the results, has a high signal to noise background ratio, are easy to use, can be modified for automation and miniaturization, and provide verification that a compound specifically modulates TRPM5.
  [FR] Pour les besoins de la technique, l'invention concerne des essais de dépistage à haut rendement permettant d'identifier des composés qui modulent spécifiquement l'activité de canaux ioniques à action rapide, du type TRPM5. Les procédés existants pêchent par manque de sensibilité et par faible rendement, et ils sont exigeants en main-d'oeuvre. Les procédés décrits reposent sur des essais à fluorescence, fournissant une lecture optique qui assure une production rapide de résultats, sur la base d'un rapport élevé signal/bruit de fond ; enfin, ces procédés sont faciles à utiliser, on peut les modifier aux fins d'automatisation et de miniaturisation, et ils permettent de vérifier qu'un composé exerce une modulation spécifique de TRPM5.