3-[4-[4-(1-Benzothiophen-3-yl)piperidin-1-yl]butyl]-5,5-dimethyl-1,1-dioxo-1,3-thiazolidin-4-one

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻吩类
• 英文名称: 3-[4-[4-(1-Benzothiophen-3-yl)piperidin-1-yl]butyl]-5,5-dimethyl-1,1-dioxo-1,3-thiazolidin-4-one
• 化学式: C₂₂H₃₀N₂O₃S₂
• 分子量: 434.6
• InChiKey: OLKFDMVDFMZBLM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  94.3
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• 3-(4-(1-Substituted-4-piperazinyl)butyl)-4-thiazolidinone and related compounds
  申请人：HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED

  公开号：EP0699675A2

  公开（公告）日：1996-03-06

  There are disclosed compounds of the formula, where n is 0, 1 or 2; A is where X in each occurrence is independently hydrogen, halogen, loweralkyl, hydroxy, nitro, loweralkoxy, amino, cyano, trifluoromethyl or methylthio; Y in each occurrence is independently hydrogen, halogen, loweralkyl, hydroxy, nitro, loweralkoxy, amino, cyano, trifluoromethyl or methylthio; K is N or CH; m is 1 or 2; k is 1 or 2; R₁ and R₂ are independently hydrogen, loweralkyl, or aryl except that when R₁ is or aryl, R₂ is hydrogen, or alternatively R₁ + R₂ taken together with the carbon atom to which they are attached form a cyclopentane, cyclopentane, cyclohexane, cycloheptane, pyran, thiopyran, indan or piperidine ring; R₃ and R₄ are independently hydrogen or loweralkyl, or alternatively R₃ + R₄ taken together with the carbon atom to which they are attached form a cyclopentane, cyclohexane, cycloheptane, pyran, thiopyran, pyrrolidine or piperidine ring, the term aryl signifying an unsubstituted phenyl group or a phenyl group substituted with 1, 2 or 3 substituents each of which being independently loweralkyl, loweralkoxy, hydroxy, halogen, loweralkylthio, cyano, amino or trifluoromethyl, which are useful as antipsychotic, analgesic, anticonvulsant and anxiolytic agents.

  已公开的化合物式如下 其中 n 是 0、1 或 2；A 是 其中 X 在每次出现时独立地为氢、卤素、低级烷基、羟基、硝基、低级烷氧基、氨基、氰基、三氟甲基或甲硫基；Y 在每次出现时独立地为氢、卤素、低级烷基、羟基、硝基、低级烷氧基、氨基、氰基、三氟甲基或甲硫基；K 为 N 或 CH；m 为 1 或 2；k 为 1 或 2；R₁ 和 R₂ 独立地为氢、低级烷基、 或芳基，但当 R₁ 是 或芳基时，R₂为氢，或者 R₁ + R₂ 与它们所连接的碳原子一起形成环戊烷、环戊烷、环己烷、环庚烷、吡喃、硫吡喃、茚满或哌啶环；R₃ 和 R₄ 独立地为氢或低级烷基，或者 R₃ + R₄ 与它们所连接的碳原子一起形成环戊烷、环己烷、环庚烷、吡喃、硫吡喃、吡咯烷或哌啶环、芳基是指未取代的苯基或被 1、2 或 3 个取代基取代的苯基，每个取代基都是独立的低级烷基、低级烷氧基、羟基、卤素、低级烷硫基、氰基、氨基或三氟甲基，可用作抗精神病药、镇痛药、抗惊厥药和抗焦虑药。
• US6284775B1
  申请人：——

  公开号：US6284775B1

  公开（公告）日：2001-09-04