2-(4-benzo[1,3]dioxol-5-ylmethyl-[1,4]diazepan-1-ylmethyl)-1-(3,4-dimethyl-benzyl)-1H-benzoimadazole | 564487-04-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并间二氧杂环戊烯类
• 英文名称: 2-(4-benzo[1,3]dioxol-5-ylmethyl-[1,4]diazepan-1-ylmethyl)-1-(3,4-dimethyl-benzyl)-1H-benzoimadazole
• 英文别名: 2-[[4-(1,3-Benzodioxol-5-ylmethyl)-1,4-diazepan-1-yl]methyl]-1-[(3,4-dimethylphenyl)methyl]benzimidazole
• CAS: 564487-04-3
• 化学式: C₃₀H₃₄N₄O₂
• 分子量: 482.626
• InChiKey: CVQRGGVHXVANIV-UHFFFAOYSA-N

物化性质

• 沸点：
  657.5±55.0 °C(Predicted)
• 密度：
  1.23±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  36
• 可旋转键数：
  6
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  42.8
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• Melanin concentrating hormone receptor ligands: substituted 2-(4-benzyl-piperazin-1-ylmethyl)- and 2-(4-benzyl-diazepan-1-ylmethyl)-1H-benzoimidazole analogues
  申请人：——

  公开号：US20030229074A1

  公开（公告）日：2003-12-11

  Melanin concentrating hormone receptor ligands (especially substituted 2-(4-benzyl-piperazin-1-ylmethyl)-1H-benzoimidazole analogues), capable of modulating MCH receptor activity, are provided. Such ligands may be used to modulate MCH binding to MCH receptors in vivo or in vitro, and are particularly useful in the treatment of a variety of metabolic, feeding and sexual disorders in humans, domesticated companion animals and livestock animals. Pharmaceutical compositions and methods for treating such disorders are provided, as are methods for using such ligands for detecting MCH receptors (e.g., receptor localization studies).

  提供了黑色素浓缩激素受体配体（特别是取代的2-(4-苄基-哌嗪-1-基甲基)-1H-苯并咪唑类似物），能够调节MCH受体活性。这些配体可用于调节MCH与体内或体外的MCH受体结合，并在治疗人类、驯养伴侣动物和家畜动物的多种代谢、进食和性功能障碍方面特别有用。还提供了用于治疗这些障碍的药物组合物和方法，以及用于检测MCH受体的配体的方法（例如，受体定位研究）。
• EP1465635A4
  申请人：——

  公开号：EP1465635A4

  公开（公告）日：2005-04-13
• MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 2-(4-BENZYL-PIPERAZIN-1-YLMETHYL)- AND 2-(4-BENZYL-DIAZEPAN-1-YLMETHYL)-1H-BENZOIMIDAZOLE ANALOGUES
  申请人：NEUROGEN CORPORATION

  公开号：EP1465635A2

  公开（公告）日：2004-10-13
• US7160879B2
  申请人：——

  公开号：US7160879B2

  公开（公告）日：2007-01-09
• [EN] MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 2-(4-BENZYL-PIPERAZIN-1-YLMETHYL)- AND 2-(4-BENZYL-DIAZEPAN-1-YLMETHYL)-1H-BENZOIMIDAZOLE ANALOGUES<br/>[FR] LIGANDS RECEPTEURS DE L'HORMONE DE CONCENTRATION DE LA MELANINE: 2-(4-BENZYL-PIPERAZINE-1-YLMETHYL)- SUBSTITUE ET ANALOGUES DE 2-(4-BENZYL-DIAZEPAN-1-YLMETHYL)-1H-BENZOIMIDAZOLE
  申请人：NEUROGEN CORP

  公开号：WO2003060475A2

  公开（公告）日：2003-07-24

  Melanin concentrating hormone receptor ligands (especially substituted 2-(4-benzyl-piperazin-1-ylmethyl)-1H-benzoimidazole analogues), capable of modulating MCH receptor activity, are provided. Such ligands may be used to modulate MCH binding to MCH receptors in vivo or in vitro, and are particularly useful in the treatment of a variety of metabolic, feeding and sexual disorders in humans, domesticated companion animals and livestock animals. Pharmaceutical compositions and methods for treating such disorders are provided, as are methods for using such ligands for detecting MCH receptors (e.g., receptor localization studies).