埃替拉韦酰基葡糖苷酸 | 870649-25-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 埃替拉韦酰基葡糖苷酸
• 英文名称: Elvitegravir acyl glucuronide
• 英文别名: (2S,3S,4S,5R,6S)-6-[6-[(3-chloro-2-fluorophenyl)methyl]-1-[(2S)-1-hydroxy-3-methylbutan-2-yl]-7-methoxy-4-oxoquinoline-3-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
• CAS: 870649-25-5
• 化学式: C₂₉H₃₁ClFNO₁₁
• 分子量: 624.0
• InChiKey: WPHAZPCTEVBKES-JEPPDLIRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  43
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  183
• 氢给体数：
  5
• 氢受体数：
  13

文献信息

• Novel 4-oxoquinoline compound and use thereof as HIV integrase inhibitor
  申请人：Satoh Motohide

  公开号：US20060019906A1

  公开（公告）日：2006-01-26

  Provision of a compound having an anti-HIV activity, particularly an integrase inhibitory activity. A 4-oxoquinoline compound represented by the following formula [I] or a pharmaceutically acceptable salt thereof: wherein each symbol is as defined in the specification. The present invention also relates to a pharmaceutical composition containing the 4-oxoquinoline compound or a pharmaceutically acceptable salt thereof, and a pharmaceutically acceptable carrier; an integrase inhibitor, an antiviral agent, anti-HIV agent, and the like, which contains the 4-oxoquinoline compound or a pharmaceutically acceptable salt thereof as an active ingredient; an anti-HIV composition containing the 4-oxoquinoline compound or a pharmaceutically acceptable salt thereof, and one or more other kinds of anti-HIV activity substances as active ingredients; an anti-HIV agent containing the 4-oxoquinoline compound or a pharmaceutically acceptable salt thereof as an active ingredient, which is used for a multiple drug therapy with other anti-HIV agent(s), and the like.

  提供一种具有抗HIV活性，特别是整合酶抑制活性的化合物。该化合物为以下式[I]所表示的4-氧喹啉化合物或其药学上可接受的盐：其中每个符号如说明书中所定义。本发明还涉及含有4-氧喹啉化合物或其药学上可接受的盐以及药学上可接受的载体的制药组合物；含有4-氧喹啉化合物或其药学上可接受的盐作为活性成分的整合酶抑制剂、抗病毒剂、抗HIV剂等；含有4-氧喹啉化合物或其药学上可接受的盐以及一种或多种其他种类的抗HIV活性物质作为活性成分的抗HIV组合物；含有4-氧喹啉化合物或其药学上可接受的盐作为活性成分的抗HIV剂，可用于与其他抗HIV剂进行多种药物疗法等。
• US7531554B2
  申请人：——

  公开号：US7531554B2

  公开（公告）日：2009-05-12