5-{3-[4-(4-fluoroindol-3-yl)-1,2,5,6-tetrahydropyrid-1-yl]propoxy}-2-methylbenzothiazole

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻唑类
• 英文名称: 5-{3-[4-(4-fluoroindol-3-yl)-1,2,5,6-tetrahydropyrid-1-yl]propoxy}-2-methylbenzothiazole
• 英文别名: 5-[3-[4-(4-fluoro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]propoxy]-2-methyl-1,3-benzothiazole
• 化学式: C₂₄H₂₄FN₃OS
• 分子量: 421.538
• InChiKey: YFDBYYAMYFHVAP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  30
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  69.4
• 氢给体数：
  1
• 氢受体数：
  5

文献信息

• Antipsychotic heterocycle compounds
  申请人：——

  公开号：US20020072611A1

  公开（公告）日：2002-06-13

  Compounds of Formula I are useful antipsychotic and antidepressant agents demonstrating potent inhibition of 5-HT reuptake and dopamine D2 receptor antagonism. Ar—Y—(CH 2 ) m —Z   I In Formula I: Ar is selected from 1 Z is II or III; 2 Y is sulfur or oxygen; R 1 and R 4 are independently selected from H and lower alkyl; R 2 , R 3 , R 6 and R 7 are independently selected from H, halogen, and lower alkoxy; R 5 is selected from H, halogen, lower alkoxy and cyano; m is an integer from 2-6; n is zero or the integer 1 or 2; and a dotted line represents an optional double bond.

  式I的化合物是有用的抗精神病和抗抑郁药物，表现出对5-HT再摄取和多巴胺D2受体的强效抑制作用。Ar—Y—(CH2)m—Z 在式I中：Ar从1中选择Z为II或III；2Y为硫或氧；R1和R4分别选择自H和较低的烷基；R2、R3、R6和R7分别选择自H、卤素和较低的烷氧基；R5从H、卤素、较低的烷氧基和氰基中选择；m为2-6之间的整数；n为零或整数1或2；虚线代表可选的双键。
• EP1242072A4
  申请人：——

  公开号：EP1242072A4

  公开（公告）日：2004-02-04
• ANTIPSYCHOTIC HETEROCYCLE COMPOUNDS
  申请人：Bristol-Myers Squibb Company

  公开号：EP1242072A1

  公开（公告）日：2002-09-25
• US6476051B2
  申请人：——

  公开号：US6476051B2

  公开（公告）日：2002-11-05
• [EN] ANTIPSYCHOTIC HETEROCYCLE COMPOUNDS<br/>[FR] COMPOSES HETEROCYCLIQUES ANTIPSYCHOTIQUES
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2001043740A1

  公开（公告）日：2001-06-21

  Compounds of Formula (I) are useful antipsychotic and antidepressant agents demonstrating potent inhibition of 5-HT reuptake and dopamine D2 receptor antogonism. In Formula (I): Ar is selected from (a) and (b); Z is (II) or (III); Y is sulfur or oxygen; R?1 and R4¿ are independently selected from H and lower alkyl; R?2, R3, R6 and R7¿ are independently selected from H, halogen, and lower alkoxy; R5 is selected from H, halogen, lower alkoxy and cyano; m is an integer from 2-6; n is zero or the integer 1 or 2; and a dotted line represents an optional double bond.