4-(6-bromo-pyridazin-3-yl)-1, 4-diazabicyclo [3.2. 2] nonane | 695184-05-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 4-(6-bromo-pyridazin-3-yl)-1, 4-diazabicyclo [3.2. 2] nonane
• 英文别名: 4-(6-Bromopyridazin-3-yl)-1,4-diazabicyclo[3.2.2]nonane
• CAS: 695184-05-5
• 化学式: C₁₁H₁₅BrN₄
• 分子量: 283.171
• InChiKey: HDTMGTDXVWAWEJ-UHFFFAOYSA-N

物化性质

• 沸点：
  452.5±40.0 °C(Predicted)
• 密度：
  1.57±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  32.3
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-(6-bromo-pyridazin-3-yl)-1, 4-diazabicyclo [3.2. 2] nonane 在 bis-triphenylphosphine-palladium(II) chloride 作用下， 以 甲醇 、 DMF (N,N-dimethyl-formamide) 、 乙醚 为溶剂， 反应 15.0h， 生成 4-(6-selenophen-3-yl-pyridazin-3-yl)-1, 4-diazabicyclo[3. 2.2]nonane fumaric acid salt
  参考文献：
  名称：

  Novel diazabicyclic biaryl derivatives

  摘要：

  该发明涉及新型的二氮杂双环联苯衍生物，发现它们在尼古丁乙酰胆碱受体上是胆碱能配体，并且调节单胺受体和转运体。由于它们的药理特性，该发明的化合物可能对治疗与中枢神经系统（CNS）的胆碱能系统、外周神经系统（PNS）、平滑肌收缩相关的疾病或紊乱、内分泌疾病或紊乱、神经退行性疾病或紊乱、炎症相关的疾病或紊乱、疼痛以及由于滥用化学物质终止而引起的戒断症状可能有用。

  公开号：

  US20040127491A1
• 作为产物：
  描述：

  3-奎宁环酮盐酸盐 在 sodium hydroxide 、 lithium aluminium tetrahydride 、 PPA 、 盐酸羟胺 、 sodium acetate 作用下， 以 1,4-二氧六环 、 水 为溶剂， 反应 7.83h， 生成 4-(6-bromo-pyridazin-3-yl)-1, 4-diazabicyclo [3.2. 2] nonane
  参考文献：
  名称：

  Novel diazabicyclic biaryl derivatives

  摘要：

  该发明涉及新型的二氮杂双环联苯衍生物，发现它们在尼古丁乙酰胆碱受体上是胆碱能配体，并且调节单胺受体和转运体。由于它们的药理特性，该发明的化合物可能对治疗与中枢神经系统（CNS）的胆碱能系统、外周神经系统（PNS）、平滑肌收缩相关的疾病或紊乱、内分泌疾病或紊乱、神经退行性疾病或紊乱、炎症相关的疾病或紊乱、疼痛以及由于滥用化学物质终止而引起的戒断症状可能有用。

  公开号：

  US20040127491A1

文献信息

• [EN] DIAZABICYCLIC ARYL DERIVATIVES AS CHOLINERGIC RECEPTOR MODULATORS<br/>[FR] DERIVES D'ARYLE DIAZABICYCLIQUES CONSTITUANT DES MODULATEURS DES RECEPTEURS CHOLINERGIQUES
  申请人：NEUROSEARCH AS

  公开号：WO2005074940A1

  公开（公告）日：2005-08-18

  This invention relates to novel diazabicyclic aryl derivatives which are found to be cholinergic ligands at the nicotinic acetylcholine receptors and modulators of the monoamine receptors and transporters. Due to their pharmacological profile the compounds of the invention may be useful for the treatment of diseases or disorders as diverse as those related to the cholinergic system of the central nervous system (CNS), the peripheral nervous system (PNS), diseases or disorders related to smooth muscle contraction, endocrine diseases or disorders, diseases or disorders related to neuro-degeneration, diseases or disorders related to inflammation, pain, and withdrawal symptoms caused by the termination of abuse of chemicals substances.

  这项发明涉及新型的二氮杂双环芳基衍生物，发现它们在尼古丁乙酰胆碱受体上是胆碱能配体，并且调节单胺受体和转运体。由于它们的药理特性，本发明的化合物可能对治疗与中枢神经系统（CNS）的胆碱能系统、外周神经系统（PNS）、平滑肌收缩相关的疾病或障碍、内分泌疾病或障碍、神经退行性疾病或障碍、炎症相关的疾病或障碍、疼痛以及由于滥用化学物质而导致的戒断症状等多种疾病或障碍具有用处。
• [EN] 1,4-DIAZABICYCLO (3,2,2)NONANE DERIVATIVES, PREPARATION AND THERAPEUTICAL USE THEREOF<br/>[FR] DERIVES DE 1,4-DIAZABICYCLO (3,2,2)NONANE, PREPARATION ET UTILISATIONS THERAPEUTIQUES DE CES DERIVES
  申请人：NEUROSEARCH AS

  公开号：WO2004043960A1

  公开（公告）日：2004-05-27

  This invention relates to novel diazabicyclic biaryl derivatives, which are found to be cholinergic ligands at the nicotinic acetylcholine receptors and modulators of the monoamine receptors and transporters. Due to their pharmacological profile the compounds of the invention may be useful for the treatment of diseases or disorders as diverse as those related to the cholinergic system of the central nervous system (CNS), the peripheral nervous system (PNS), diseases or disorders related to smooth muscle contraction, endocrine diseases or disorders, diseases or disorders related to neuro-degeneration, diseases or disorders related to inflammation, pain, and withdrawal symptoms caused by the termination of abuse of chemical substances.

  这项发明涉及新型的二氮杂双环联苯衍生物，发现它们在尼古丁酰胆碱受体上是胆碱能配体，并且可以调节单胺受体和转运体。由于它们的药理特性，该发明的化合物可能对治疗与中枢神经系统（CNS）的胆碱能系统、外周神经系统（PNS）、平滑肌收缩相关的疾病或疾病、内分泌疾病或疾病、神经退行性疾病或疾病、炎症、疼痛以及因滥用化学物质而引起的戒断症状相关的疾病或疾病可能有用。
• [EN] DIMERIC AZACYCLIC COMPOUNDS AND THEIR USE<br/>[FR] NOUVEAUX COMPOSES AZACYCLIQUES DIMERES ET LEUR UTILISATION
  申请人：NEUROSEARCH AS

  公开号：WO2005075479A1

  公开（公告）日：2005-08-18

  This invention relates to azacyclic derivatives according of formula (I) and their use as pharmaceuticals. Due to their pharmacological profile the compounds of the invention may be useful for the treatment of diseases or disorders as diverse as those related to the cholinergic system of the central nervous system (CNS), the peripheral nervous system (PNS), diseases or disorders related to smooth muscle contraction, endocrine diseases or disorders, diseases or. disorders related to neuro-degeneration, diseases or disorders related to inflammation, pain, and withdrawal symptoms caused by the' termination of abuse of chemical substances. Formula (I) Aza-X'-A'-Y'-L-Y-A'-X'-Aza Aza:Azabicyclic group A',A':Aromatic monocyclic and/or polycyclic, carbocyclic and /or heterocyclic group Y',Y': Linker or absent (covalent bond) L: Monocyclic or polycyclic, carbocyclic or heterocyclic group or is absent X',X': Linker or absent (covalent bond)

  该发明涉及公式（I）的氮杂环衍生物及其作为药物的用途。由于它们的药理特性，该发明的化合物可能对治疗与中枢神经系统（CNS）的胆碱系统、外周神经系统（PNS）、平滑肌收缩、内分泌疾病、神经退行性疾病、炎症、疼痛以及由化学物质滥用终止引起的戒断症状等多种疾病或紊乱有用。公式（I）：Aza-X'-A'-Y'-L-Y-A'-X'-Aza Aza：氮杂双环基团 A'，A'：芳香单环和/或多环、碳环和/或杂环基团 Y'，Y'：连接基或不存在（共价键） L：单环或多环、碳环或杂环基团或不存在 X'，X'：连接基或不存在（共价键）
• Diazabicyclic Aryl Derivatives as Cholinergic Receptor Modulators
  申请人：Peters Dan

  公开号：US20080227773A1

  公开（公告）日：2008-09-18

  This invention relates to novel diazabicyclic aryl derivatives which are found to be cholinergic ligands at the nicotinic acetylcholine receptors and modulators of the monoamine receptors and transporters. Due to their pharmacological profile the compounds of the invention may be useful for the treatment of diseases or disorders as diverse as those related to the cholinergic system of the central nervous system (CNS), the peripheral nervous system (PNS), diseases or disorders related to smooth muscle contraction, endocrine diseases or disorders, diseases or disorders related to neuro-degeneration, diseases or disorders related to inflammation, pain, and withdrawal symptoms caused by the termination of abuse of chemicals substances.

  本发明涉及新型的二氮杂双环芳基衍生物，这些衍生物被发现是乙酰胆碱受体的胆碱能配体，以及单胺类受体和转运体的调节剂。由于它们的药理特性，本发明的化合物可能对治疗与中枢神经系统（CNS）和外周神经系统（PNS）的胆碱能系统相关的疾病或障碍，平滑肌收缩相关的疾病或障碍，内分泌疾病或障碍，神经退行性疾病或障碍，炎症、疼痛以及因滥用化学物质的终止而引起的戒断症状等多种疾病或障碍具有用处。
• Diazabicyclic biaryl derivatives
  申请人：Neurosearch A/S

  公开号：US07223753B2

  公开（公告）日：2007-05-29

  This invention relates to novel diazabicyclic biaryl derivatives, which are found to be cholinergic ligands at the nicotinic acetylcholine receptors and modulators of the monoamine receptors and transporters. Due to their pharmacological profile the compounds of the invention may be useful for the treatment of diseases or disorders as diverse as those related to the cholinergic system of the central nervous system (CNS), the peripheral nervous system (PNS), diseases or disorders related to smooth muscle contraction, endocrine diseases or disorders, diseases or disorders related to neuro-degeneration, diseases or disorders related to inflammation, pain, and withdrawal symptoms caused by the termination of abuse of chemical substances.

  本发明涉及新型的二氮杂双环联苯衍生物，这些衍生物被发现是乙酰胆碱受体的胆碱能配体，并且是单胺类受体和转运体的调节剂。由于它们的药理特性，本发明的化合物可能对与中枢神经系统（CNS）和外周神经系统（PNS）的胆碱能系统有关的疾病或疾病，与平滑肌收缩有关的疾病或疾病，内分泌疾病或疾病，与神经退行性有关的疾病或疾病，与炎症、疼痛和化学物质滥用终止引起的戒断症状有关的疾病或疾病的治疗有用。