7-[(4-Ethoxyphenyl)(pyridin-2-ylamino)methyl]-2-methylquinolin-8-ol

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 7-[(4-Ethoxyphenyl)(pyridin-2-ylamino)methyl]-2-methylquinolin-8-ol
• 英文别名: 7-[(4-ethoxyphenyl)-(pyridin-2-ylamino)methyl]-2-methylquinolin-8-ol
• 化学式: C₂₄H₂₃N₃O₂
• 分子量: 385.5
• InChiKey: IPCYHANDABLLHX-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：
  0.17
• 拓扑面积：
  67.3
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• Small molecule inhibitors of botulinum neurotoxins
  申请人：Roxas-Duncan Virginia I.

  公开号：US10301265B2

  公开（公告）日：2019-05-28

  The invention provides potent quinolinol-based BoNT/A small-molecule inhibitors of botulinum neurotoxins, in particular of Clostridium botulinum serotype A neurotoxins. The invention also provides methods of using these small-molecule inhibitors to inhibit infections by Clostridium botulinum, as well as, methods of preventing infections by Clostridium botulinum through materials that may be ingested.

  本发明提供了肉毒杆菌神经毒素，特别是肉毒杆菌血清型A神经毒素的强效喹啉醇基BoNT/A小分子抑制剂。本发明还提供了使用这些小分子抑制剂抑制肉毒梭菌感染的方法，以及通过可能摄入的材料预防肉毒梭菌感染的方法。
• SMALL MOLECULE INHIBITORS OF BOTULINUM NEUROTOXINS
  申请人：Roxas-Duncan Virginia I.

  公开号：US20110294848A1

  公开（公告）日：2011-12-01

  The invention provides potent quinolinol-based BoNT/A small-molecule inhibitors of botulinum neurotoxins, in particular of Clostridium botulinum serotype A neurotoxins. The invention also provides methods of using these small-molecule inhibitors to inhibit infections by Clostridium botulinum , as well as, methods of preventing infections by Clostridium botulinum through materials that may be ingested.
• GLYCOSAMINOGLYCAN INHIBITORS
  申请人：Crawford Brett E.

  公开号：US20120295890A1

  公开（公告）日：2012-11-22

  Provided herein are chondroitin sulfate inhibitors, including modulators of glycosylation, and/or sulfation of galactose or N-acetyl galactosamine glycosaminoglycans.
• [EN] GLYCOSAMINOGLYCAN INHIBITORS<br/>[FR] INHIBITEURS DE GLYCOSAMINOGLYCANE
  申请人：ZACHARON PHARMACEUTICALS INC

  公开号：WO2011082175A2

  公开（公告）日：2011-07-07

  Provided herein are chondroitin sulfate inhibitors, including modulators of glycosylation, and/or sulfation of galactose or N-acetyl galactosamine glycosaminoglycans.