5'-amino-3'-(6-carbamimidoyl-4-phenyl-1,2,3,4-tetrahydro-quinolin-2-yl)-biphenyl-2-carboxylic acid

• 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: 5'-amino-3'-(6-carbamimidoyl-4-phenyl-1,2,3,4-tetrahydro-quinolin-2-yl)-biphenyl-2-carboxylic acid
• 英文别名: 2-[3-Amino-5-(6-carbamimidoyl-4-phenyl-1,2,3,4-tetrahydroquinolin-2-yl)phenyl]benzoic acid
• 化学式: C₂₉H₂₆N₄O₂
• 分子量: 462.551
• InChiKey: XUJJWQQLMFLJKO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  35
• 可旋转键数：
  5
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  125
• 氢给体数：
  5
• 氢受体数：
  5

文献信息

• [EN] TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS SERINE PROTEASE INHIBITORS<br/>[FR] DERIVES DE TETRAHYDROQUINOLINE UTILES EN TANT QU'INHIBITEURS DE SERINE PROTEASE
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2004080971A1

  公开（公告）日：2004-09-23

  The present invention provides compounds of Formula (I) ; or a stereoisomer or pharmaceutically acceptable salt form thereof, wherein the variables A, B, L1, L2, X1, X2, X3, X4, R4, R5, R13, R14, R15 and R16 are as defined herein. The compounds of Formula (I) are useful as selective inhibitors of serine protease enzymes of the coagulation cascade and/or contact activation system; for example thrombin, factor Xa, factor XIa, factor IXa, factor VIIa and/or plasma kallikrein. In particular, it relates to compounds that are selective factor XIa inhibitors. This invention also relates to pharmaceutical compositions comprising these compounds and methods of treating thromboembolic and/or inflammatory disorders using the same.

  本发明提供了式（I）的化合物；或其立体异构体或药用可接受的盐形式，其中变量A、B、L1、L2、X1、X2、X3、X4、R4、R5、R13、R14、R15和R16如本文所定义。式（I）的化合物可用作凝血级联和/或接触激活系统的丝氨酸蛋白酶酶的选择性抑制剂；例如凝血酶、因子Xa、因子XIa、因子IXa、因子VIIa和/或血浆激肽。具体而言，涉及选择性因子XIa抑制剂的化合物。本发明还涉及包含这些化合物的药物组合物以及使用它们治疗血栓栓塞和/或炎症性疾病的方法。
• Tetrahydroquinoline derivatives useful as serine protease inhibitors
  申请人：——

  公开号：US20040235847A1

  公开（公告）日：2004-11-25

  The present invention provides compounds of Formula (I): 1 or a stereoisomer or pharmaceutically acceptable salt form thereof, wherein the variables A, B, L 1 , L 2 , X 1 , X 2 , X 3 , X 4 , R 4 , R 5 , R 13 , R 14 , R 15 and R 16 are as defined herein. The compounds of Formula (I) are useful as selective inhibitors of serine protease enzymes of the coagulation cascade and/or contact activation system; for example thrombin, factor Xa, factor XIa, factor IXa, factor VIIa and/or plasma kallikrein. In particular, it relates to compounds that are selective factor XIa inhibitors. This invention also relates to pharmaceutical compositions comprising these compounds and methods of treating thromboembolic and/or inflammatory disorders using the same.

  本发明提供了公式（I）的化合物：1或其立体异构体或药学上可接受的盐形式，其中变量A、B、L1、L2、X1、X2、X3、X4、R4、R5、R13、R14、R15和R16如本文所定义。公式（I）的化合物可用作凝血级联和/或接触激活系统的丝氨酸蛋白酶酶的选择性抑制剂；例如凝血酶、因子Xa、因子XIa、因子IXa、因子VIIa和/或血浆激肽。特别地，涉及选择性因子XIa抑制剂的化合物。本发明还涉及包含这些化合物的制药组合物和使用它们治疗血栓栓塞性和/或炎症性疾病的方法。
• EP1601656A4
  申请人：——

  公开号：EP1601656A4

  公开（公告）日：2008-06-11
• TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS SERINE PROTEASE INHIBITORS
  申请人：Bristol-Myers Squibb Company

  公开号：EP1601656A1

  公开（公告）日：2005-12-07
• US7138412B2
  申请人：——

  公开号：US7138412B2

  公开（公告）日：2006-11-21