1-[4-(Benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-YL]azepane

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1-[4-(Benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-YL]azepane
• 英文别名: 5-(azepan-1-yl)-4-(benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazole
• 化学式: C₂₂H₂₄N₂O₃S
• mdl: MFCD04565019
• 分子量: 396.5
• InChiKey: IRYJQWGLZNXAKQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  28
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  71.8
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS
  申请人：Verkman Alan S.

  公开号：US20100305105A1

  公开（公告）日：2010-12-02

  Provided herein are small molecule compounds that alter the transport activity of solute transporters, particularly urea transporters. The compounds described herein belong to the phenylsulfoxyoxazole, phenylsulfoxyimidazole, phenylsulfoxythiazole class of compounds. The compounds described herein are useful for increasing solute clearance in states of fluid overload and for treating cardiovascular, renal, and metabolic diseases, disorders, and conditions. Methods for identifying and using these agents that inhibit urea transporters are described herein.
• US8394788B2
  申请人：——

  公开号：US8394788B2

  公开（公告）日：2013-03-12
• [EN] PHENYLSULFOXYOXAZOLE COMPOUND INHIBITORS OF UREA TRANSPORTERS<br/>[FR] INHIBITEURS À COMPOSÉ SULFOXYOXAZOLE DE TRANSPORTEURS D'URÉE
  申请人：VERKMAN ALAN S

  公开号：WO2008061248A2

  公开（公告）日：2008-05-22

  [EN] Provided herein are small molecule compounds that alter the transport activity of solute transporters, particularly urea transporters. The compounds described herein belong to the phenylsulfoxyoxazole, phenylsulfoxyimidazole, phenylsulfoxythiazole class of compounds. The compounds described herein are useful for increasing solute clearance in states of fluid overload and for treating cardiovascular, renal, and metabolic diseases, disorders, and conditions. Methods for identifying and using these agents that inhibit urea transporters are described herein.
  [FR] L'invention concerne des petits composés moléculaires qui modifient l'activité de transport de transporteurs solutés, en particulier de transporteurs d'urée. Ces composés, qui appartiennent à la classe phénylsulfoxyoxazole, phénylsulfoxyimidazole, phénylsulfoxythiazole, sont utilisés pour accroître la clairance de solutés dans des conditions de surcharge liquide et pour traiter des maladies, des troubles et des états cardio-vasculaires, rénaux et métaboliques. L'invention concerne également des procédés permettant d'identifier et d'utiliser ces agents qui inhibent les transporteurs d'urée.