6-(4-methylphenyl)-1-(4-methylsulfanylphenyl)pyrimidin-2,4-(1H)-dione

• 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: 6-(4-methylphenyl)-1-(4-methylsulfanylphenyl)pyrimidin-2,4-(1H)-dione
• 英文别名: 6-(4-Methylphenyl)-1-(4-methylsulfanylphenyl)pyrimidine-2,4-dione
• 化学式: C₁₈H₁₆N₂O₂S
• 分子量: 324.403
• InChiKey: GMNFXBYTZVDDRP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  23
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  74.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  6-(4-methylphenyl)-1-(4-methylsulfanylphenyl)pyrimidin-2,4-(1H)-dione 、 溴乙酸甲酯 在 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 反应 4.33h， 以78.81%的产率得到methyl [4-(4-methylphenyl)-3-[4-(methylthio)phenyl]-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl]acetate
  参考文献：
  名称：

  WO2007/7161

  摘要：

  公开号：

文献信息

• Novel pyrimidinedione derivatives
  申请人：ORCHID CHEMICALS & PHARMACEUTICALS LIMITED

  公开号：US20040009975A1

  公开（公告）日：2004-01-15

  Pyrimidinedione derivatives of the general formula (I), their derivatives, analogs, tautomeric forms, stereoisomers, polymorphs, hydrates, solvates, pharmaceutically acceptable salts and pharmaceutically acceptable compositions containing them are useful for the treatment of inflammation and immunological diseases. 1

  式(I)的嘧啶二酮衍生物、它们的衍生物、类似物、互变异构体、立体异构体、多晶形态、水合物、溶剂化物、药学上可接受的盐以及含有它们的药学上可接受的组合物，对于治疗炎症和免疫性疾病是有用的。
• US7101873B2
  申请人：——

  公开号：US7101873B2

  公开（公告）日：2006-09-05
• US7399760B2
  申请人：——

  公开号：US7399760B2

  公开（公告）日：2008-07-15
• [EN] NOVEL PYRIMIDINEDIONE DERIVATIVES<br/>[FR] NOUVEAUX DERIVES DE PYRIMIDINEDIONE
  申请人：ORCHID CHEMICALS & PHARM LTD

  公开号：WO2003084937A2

  公开（公告）日：2003-10-16

  The present invention relates to novel pyrimidinedione derivatives of the general formula (I), their derivatives, their analogs, their tautomeric forms, their stereoisomers, their polymorphs, their hydrates, their solvates, their pharmaceutically acceptable salts and pharmaceutically acceptable compositions containing them. The present invention more particularly provides novel pyrimidinedione derivatives of the general formula (I).
• [EN] NOVEL BIO-ACTIVE DERIVATIVES<br/>[FR] NOUVEAUX DERIVES BIOACTIFS
  申请人：ORCHID RES LAB LTD

  公开号：WO2007007161A2

  公开（公告）日：2007-01-18

  [EN] The present invention relates to novel compounds of the general formula (I), their derivatives, their analogs, their tautomeric forms, their stereoisomers, their polymorphs, their hydrates, their solvates, their pharmaceutically acceptable salts and pharmaceutically acceptable compositions containing them. The present invention more particularly provides novel compounds of the general formula (I).
  [FR] L'invention concerne de nouveaux composés de la formule générale (I), leurs dérivés, leurs analogues, leurs formes tautomères, leurs stéréoisomères, leurs polymorphes, leurs hydrates, leurs solvates, leurs sels pharmaceutiquement acceptables et des compositions pharmaceutiquement acceptables les contenant. L'invention se rapporte plus particulièrement aux nouveaux composés de la formule générale (I).