6-(1-ethylpropyl)-2-(4-methoxy-2-methylphenyl)-3,8-dimethylimidazo[1,2-a]pyridine | 941696-01-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 6-(1-ethylpropyl)-2-(4-methoxy-2-methylphenyl)-3,8-dimethylimidazo[1,2-a]pyridine
• 英文别名: 2-(4-Methoxy-2-methylphenyl)-3,8-dimethyl-6-pentan-3-ylimidazo[1,2-a]pyridine
• CAS: 941696-01-1
• 化学式: C₂₂H₂₈N₂O
• 分子量: 336.477
• InChiKey: PERHJWZUCNRSBT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.7
• 重原子数：
  25
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  26.5
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• BICYCLIC HETEROCYCLIC COMPOUND
  申请人：Nakai Hisao

  公开号：US20090281120A1

  公开（公告）日：2009-11-12

  A compound represented by the formula (I), a salt thereof, an N-oxide thereof, a solvate thereof, or a prodrug thereof: wherein X, Y, and W each independently represent a carbon atom or a nitrogen atom; Z represents CH or a nitrogen atom; R 1 represents (1) C3-10 branched alkyl which may be substituted or (2) —(CH 2 ) m —NR 4 R 5 ; R 2 and R 3 each independently represent (1) a hydrogen atom, (2) C1-4 alkyl which may be substituted with a halogen atom, hydroxy which may be protected, amino which may be protected, or carboxyl which may be protected, (3) C2-4 alkenyl, (4) C2-4 alkynyl, (5) nitrile, (6) COOR 6 , (7) CONR 7 R 8 , (8) COR 101 , (9) S(O) n R 102 , or (10) a halogen atom, in which R 6 represents a hydrogen atom or C1-4 alkyl, R 7 and R 8 each independently represent a hydrogen atom or C1-4 alkyl, R 101 represents a hydrogen atom or C1-4 alkyl, R 102 represents C1-4 alkyl, n represents 1 or 2; and Ar represents an aromatic ring which may be substituted, is useful as a pharmacologically active ingredient having a CRF antagonist action in preventing and/or treating neuropsychiatric diseases, diseases of peripheral organs or the like.

  化合物的化学式为（I），其盐，N-氧化物，溶剂化合物或前药：其中X，Y和W各自独立地表示碳原子或氮原子；Z表示CH或氮原子；R1表示（1）C3-10支链烷基，可以被取代或（2）—（CH2）m—NR4R5；R2和R3各自独立地表示（1）氢原子，（2）C1-4烷基，可以用卤原子，羟基，氨基或羧基进行保护取代，（3）C2-4烯基，（4）C2-4炔基，（5）腈基，（6）COOR6，（7）CONR7R8，（8）COR101，（9）S（O）nR102或（10）卤原子，其中R6表示氢原子或C1-4烷基，R7和R8各自独立地表示氢原子或C1-4烷基，R101表示氢原子或C1-4烷基，R102表示C1-4烷基，n表示1或2；而Ar表示一个芳香环，可以被取代，是一种具有CRF拮抗剂作用的药理活性成分，可用于预防和/或治疗神经精神疾病，外周器官疾病等。