1-{[(3,5-dichloro-2'-{4-chloro-3-[3-(dimethylamino)propoxy]phenyl}-2,3'-bipyridin-6'-yl)carbonyl]amino}cyclohexanecarboxylic acid hydrochloride | 1180743-58-1

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 1-{[(3,5-dichloro-2'-{4-chloro-3-[3-(dimethylamino)propoxy]phenyl}-2,3'-bipyridin-6'-yl)carbonyl]amino}cyclohexanecarboxylic acid hydrochloride
• 英文别名: 1-{[(3,5-Dichloro-2'-{4-chloro-3-[3-(dimethylamino)propoxy]phenyl}-2,3'-bipyridin-6'-yl)carbonyl]amino}cyclo-hexanecarboxylic acid hydrochloride；1-[[6-[4-chloro-3-[3-(dimethylamino)propoxy]phenyl]-5-(3,5-dichloropyridin-2-yl)pyridine-2-carbonyl]amino]cyclohexane-1-carboxylic acid;hydrochloride
• CAS: 1180743-58-1
• 化学式: C₂₉H₃₁Cl₃N₄O₄*ClH
• 分子量: 642.409
• InChiKey: OWYHTZRWDHJASO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.04
• 重原子数：
  41
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  105
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  甲醇 、 1-{[(3,5-dichloro-2'-{4-chloro-3-[3-(dimethylamino)propoxy]phenyl}-2,3'-bipyridin-6'-yl)carbonyl]amino}cyclohexanecarboxylic acid hydrochloride 在 氯化亚砜 作用下， 反应 20.0h， 以87%的产率得到methyl 1-{[(3,5-dichloro-2'-{4-chloro-3-[3-(dimethylamino)propoxy]phenyl}-2,3'-bipyridin-6'-yl)carbonyl]amino}cyclohexanecarboxylate hydrochloride
  参考文献：
  名称：

  5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS UROTENSIN II RECEPTOR ANTAGONISTS

  摘要：

  这项发明涉及5,6-双芳基-2-吡啶甲酰胺，以及它们的制备和作为尿苷II受体拮抗剂的治疗用途。

  公开号：

  US20110009426A1
• 作为产物：
  描述：

  1-氨基-1-环己基甲酸 、 3,5-dichloro-2'-{4-chloro-3-[3-(dimethylamino)propoxy]phenyl}-2,3'-bipyridine-6'-carboxylic acid 在 O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate 、 N,N-二异丙基乙胺 、 N,O-双三甲硅基乙酰胺 、 盐酸 作用下， 以 N-甲基吡咯烷酮 、 乙腈 、 水 为溶剂， 反应 20.0h， 以50%的产率得到1-{[(3,5-dichloro-2'-{4-chloro-3-[3-(dimethylamino)propoxy]phenyl}-2,3'-bipyridin-6'-yl)carbonyl]amino}cyclohexanecarboxylic acid hydrochloride
  参考文献：
  名称：

  5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS UROTENSIN II RECEPTOR ANTAGONISTS

  摘要：

  这项发明涉及5,6-双芳基-2-吡啶甲酰胺，以及它们的制备和作为尿苷II受体拮抗剂的治疗用途。

  公开号：

  US20110009426A1

文献信息

• 5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION AND APPLICATION THEREOF IN THERAPEUTICS AS UROTENSIN II RECEPTOR ANTAGONISTS
  申请人：Altenburger Jean-Michel

  公开号：US20090318473A1

  公开（公告）日：2009-12-24

  The present invention relates to derivatives of 5,6-bisaryl-2-pyridine-carboxamide, their preparation and their application in therapeutics as antagonists of urotensin II receptors.

  本发明涉及5,6-双芳基-2-吡啶甲酰胺衍生物，其制备以及其作为尿苷Ⅱ受体拮抗剂在治疗学中的应用。
• 5, 6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION AND APPLICATION THEREOF IN THERAPEUTICS AS UROTENSIN II RECEPTOR ANTAGONISTS
  申请人：Altenburger Jean-Michel

  公开号：US20120108611A1

  公开（公告）日：2012-05-03

  The present invention relates to derivatives of 5,6-bisaryl-2-pyridine-carboxamide, their preparation and their application in therapeutics as antagonists of urotensin II receptors.

  本发明涉及5,6-双芳基-2-吡啶羧酰胺衍生物，它们的制备以及它们作为尿泰松II受体拮抗剂在治疗学中的应用。
• 5,6-bisaryl-2-pyridine-carboxamide derivatives, preparation and application thereof in therapeutics as urotensin II receptor antagonists
  申请人：Sanofi-Aventis

  公开号：US08110579B2

  公开（公告）日：2012-02-07

  The present invention relates to derivatives of 5,6-bisaryl-2-pyridine-carboxamide, their preparation and their application in therapeutics as antagonists of urotensin II receptors.

  本发明涉及5,6-双芳基-2-吡啶羧酰胺衍生物，其制备方法以及作为尿加压素II受体拮抗剂在治疗领域的应用。
• 5, 6-bisaryl-2-pyridine-carboxamide derivatives, preparation and application thereof in therapeutics as urotensin II receptor antagonists
  申请人：Altenburger Jean-Michel

  公开号：US08552201B2

  公开（公告）日：2013-10-08

  The present invention relates to derivatives of 5,6-bisaryl-2-pyridine-carboxamide, their preparation and their application in therapeutics as antagonists of urotensin II receptors.

  本发明涉及5,6-双芳基-2-吡啶羧酰胺衍生物，其制备以及其作为尿腺素II受体拮抗剂在治疗学中的应用。
• 5,6-bisaryl-2-pyridine-carboxamide derivatives, preparation thereof and therapeutic application thereof as urotensin II receptor antagonists
  申请人：Altenburger Jean-Michel

  公开号：US08653276B2

  公开（公告）日：2014-02-18

  The present invention is directed to compounds of the general formula: as defined herein, and pharmaceutical compositions thereof. The invention is also directed to their therapeutic use as urotensin II receptor antagonists, e.g., in the treatment of cardiac, coronary, and central nervous system disorders. In particular embodiments, the invention relates to 5,6-bisaryl-2-pyridinecarboxamides, to their preparation and to their therapeutic use as urotensin II receptor antagonists.

  本发明涉及一般式为：如所定义的化合物及其制药组合物。本发明还涉及它们作为尿钠肽II受体拮抗剂的治疗用途，例如在治疗心脏、冠状动脉和中枢神经系统疾病中。在特定实施例中，本发明涉及5,6-双芳基-2-吡啶羧酰胺的制备及其作为尿钠肽II受体拮抗剂的治疗用途。