3-methyl-1-(5-phenyl-1H-imidazol-2-yl)butan-1-amine

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-methyl-1-(5-phenyl-1H-imidazol-2-yl)butan-1-amine
• 化学式: C₁₄H₁₉N₃
• mdl: MFCD12105963
• 分子量: 229.32
• InChiKey: PNSVTPKUIWQSLL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.357
• 拓扑面积：
  54.7
• 氢给体数：
  2
• 氢受体数：
  2

文献信息

• Derivatives of heterocycles with 5 members, their preparation and their use as medicaments
  申请人：Chabrier De Lassauniere Pierre-Etienne

  公开号：US20050038087A1

  公开（公告）日：2005-02-17

  The invention relates to thiazole, oxazole, imidazole, isoxazole and isoxazoline derivatives of general formula (I) wherein Het is thiazole, oxazole, imidazole, isoxazole or isoxazoline, n is an integer from 0 to 6, A is notably selected from various optionally substituted aromatic radicals, B is notably hydrogen, alkyl or phenyl, R 1 and R 2 are notably independently hydrogen, alkyl or cycloalkyl or R 1 and R 2 , taken together with the carbon atom which carries them, form a carbocycle with 3 to 7 members and Ω is —NR 46 R 47 or —OR 48 , R 46 and R 47 are notably independently hydrogen, alkyl, cycloalkyl or —(CH 2 ) k —COOR 51 , R 51 is notably alkyl or haloalkyl and R 48 is notably hydrogen or alkyl. These compounds have advantageous pharmacological properties which allow their use in therapeutics, notably for treating neurodegenerative disorders or pain.

  本发明涉及噻唑、噁唑、咪唑、异噁唑和异噁唑啉的一般式(I)衍生物，其中Het为噻唑、噁唑、咪唑、异噁唑或异噁唑啉，n为0至6的整数，A特别选自各种可任选取代的芳香基团，B特别为氢、烷基或苯基，R1和R2特别独立地为氢、烷基或环烷基，或者R1和R2与携带它们的碳原子一起形成具有3至7个成员的碳环，Ω为—NR46R47或—OR48，R46和R47特别独立地为氢、烷基、环烷基或—(CH2)k—COOR51，R51特别为烷基或卤代烷基，R48特别为氢或烷基。这些化合物具有有利的药理特性，使其可用于治疗学，特别是用于治疗神经退行性疾病或疼痛。