2-[(5R,3R)-5-(2,4-difluorophenyl)-tetrahydro-5-(1H-1,2,4-triazol-1-yl-methyl)-furan-3-yl-methyl]-4-{4-[4-[4-(benzyloxy)-phenyl]-1-piperazinyl]-phenyl}-2,4-dihydro-3(2H,4H)-1,2,4-triazolone | 616897-38-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 2-[(5R,3R)-5-(2,4-difluorophenyl)-tetrahydro-5-(1H-1,2,4-triazol-1-yl-methyl)-furan-3-yl-methyl]-4-{4-[4-[4-(benzyloxy)-phenyl]-1-piperazinyl]-phenyl}-2,4-dihydro-3(2H,4H)-1,2,4-triazolone
• 英文别名: 2-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methyl]-4-[4-[4-(4-phenylmethoxyphenyl)piperazin-1-yl]phenyl]-1,2,4-triazol-3-one
• CAS: 616897-38-2
• 化学式: C₃₉H₃₈F₂N₈O₃
• 分子量: 704.779
• InChiKey: LIARNCIIARBNGN-MFIBOOTFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  52
• 可旋转键数：
  11
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  91.6
• 氢给体数：
  0
• 氢受体数：
  10

文献信息

• Azabicyclic compounds for the treatment of disease
  申请人：——

  公开号：US20030232853A1

  公开（公告）日：2003-12-18

  The invention provides compounds of Formula I: 1 wherein Azabicyclo is 2 These compounds may be in the form of pharmaceutical salts or compositions, may be in pure enantiomeric form or racemic mixtures, and are useful in pharmaceuticals in which &agr;7 is known to be involved.

  这项发明提供了Formula I的化合物： 其中Azabicyclo是 这些化合物可以是药用盐或组合物的形式，可以是纯对映体形式或混合物，对已知涉及α7的药物具有用处。
• Derivatives of 2,2,4-trisubstituted tetrahydrofuran an antifungal agents
  申请人：Salman Mohammad

  公开号：US20050261330A1

  公开（公告）日：2005-11-24

  The present invention relates to derivatives of 2,2,4-trisubstituted tetrahydrofuran as potential antifungal agents. This invention also relates to pharmaceutical compositions containing the compounds of the present invention and their use in treating and/or preventing the fungal infections in mammals, preferably humans.

  本发明涉及作为潜在抗真菌剂的 2,2,4-三取代四氢呋喃的衍生物。本发明还涉及含有本发明化合物的药物组合物及其在治疗和/或预防哺乳动物（最好是人类）真菌感染中的用途。
• DERIVATIVES OF 2,2,4-TRISUBSTITUTED TETRAHYDROFURAN AS ANTIFUNGAL AGENTS
  申请人：RANBAXY LABORATORIES, LTD.

  公开号：EP1497298A1

  公开（公告）日：2005-01-19
• US6894042B2
  申请人：——

  公开号：US6894042B2

  公开（公告）日：2005-05-17
• [EN] DERIVATIVES OF 2,2,4-TRISUBSTITUTED TETRAHYDROFURAN AS ANTIFUNGAL AGENTS<br/>[FR] DERIVES DE TETRAHYDROFURANE TRISUBSTITUES 2,2,4 UTILISES COMME AGENTS ANTIFONGIQUES
  申请人：RANBAXY LAB LTD

  公开号：WO2003087106A1

  公开（公告）日：2003-10-23

  The present invention relates to derivatives of 2,2,4-trisubstituted tetrahydrofuran as potential antifungal agents. This invention also relates to pharmaceutical compositions containing the compounds of the present invention and their use in treating and/or preventing the fungal infections in mammals, preferably humans.