3-(4-bromobutyl)thiazolidine-5-spirocyclopentane-2,4-dione | 85581-61-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: 3-(4-bromobutyl)thiazolidine-5-spirocyclopentane-2,4-dione
• 英文别名: 3-(4-bromobutyl)-1-thia-3-azaspiro[4.4]nonane-2,4-dione
• CAS: 85581-61-9
• 化学式: C₁₁H₁₆BrNO₂S
• 分子量: 306.224
• InChiKey: NWABWGDCPFISMB-UHFFFAOYSA-N

物化性质

• 沸点：
  402.3±47.0 °C(Predicted)
• 密度：
  1.51±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.17
• 重原子数：
  16.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  37.38
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  3-(4-bromobutyl)thiazolidine-5-spirocyclopentane-2,4-dione 生成 2-<4-<4-(2,4-dioxo-1-thia-3-azaspiro<4.4>nonan-3-yl)butyl>-1-piperazinyl>pyridine-3-carboxaldehyde
  参考文献：
  名称：

  摘要：

  DOI：
• 作为产物：
  描述：

  2-氯-3-硝基吡啶 生成 3-(4-bromobutyl)thiazolidine-5-spirocyclopentane-2,4-dione
  参考文献：
  名称：

  摘要：

  DOI：

文献信息

• The thieno[3,2-c]pyridine and furo[3,2-c]pyridine rings: new pharmacophores with potential antipsychotic activity
  作者：James S. New、William L. Christopher、Joseph P. Yevich、Rhett Butler、R. Francis Schlemmer、Cam P. VanderMaelen、Joseph A. Cipollina

  DOI：10.1021/jm00126a002

  日期：1989.6

  Two new arylpiperazine derivatives, the 4-(1-piperazinyl)thieno- and -furo[3,2-c]pyridine ring systems, have been synthesized and appended via tetramethylene chains to various imide rings. Target compounds from each series were found to have significant activity in the blockade of apomorphine stereotypy and apomorphine-induced climbing, the Sidman avoidance response, and the conditioned avoidance response

  已经合成了两种新的芳基哌嗪衍生物，即4-（1-哌嗪基）噻吩并-和呋喃并[3,2-c]吡啶环系统，并通过四亚甲基链连接到各种酰亚胺环上。发现来自每个系列的目标化合物在阿朴吗啡定型和阿朴吗啡诱导的爬升，Sidman回避反应和条件回避反应中具有显着活性。另外，尽管对于硫代和呋喃并[3，2-c]吡啶衍生物均观察到对5-羟色胺5-HT1和5-HT2受体的强亲和力，但这些分子与多巴胺D2受体的相互作用较弱。每个系列涉及化合物22和33的先导原型的电生理研究表明，这两个分子对A9和A10区域的多巴胺神经元有明显不同的作用。
• Atypical antipsychotic agents: patterns of activity in a series of 3-substituted 2-pyridinyl-1-piperazine derivatives
  作者：James S. New、Joseph P. Yevich、Davis L. Temple、Kimberly B. New、Sharon M. Gross、R. Francis Schlemmer、Michael S. Eison、Duncan P. Taylor、Leslie A. Riblet

  DOI：10.1021/jm00398a021

  日期：1988.3

  A series of 3-substituted 2-pyridinyl-1-piperazine derivatives have been appended to cyclic imide groups and evaluated for their potential antipsychotic activity. The dopamine receptor affinities of these target molecules, as well as their ability to block apomorphine-induced stereotypy or reverse neuroleptic-induced catalepsy, was dependent on the lipophilic and electronic characteristics of the substituent situated on the pyridine ring. Groups with + omega and - phi values were most consistent with the desired biological profile of the target molecules, the cyano moiety being the optimum choice. Evaluation of compound 12 in a monkey model of amphetamine psychosis, and the regional selectivity it expresses for the A10 dopaminergic cell bodies in electrophysiological experiments, suggest this compound would be an atypical antipsychotic agent with few side effects.
• NEW, JAMES STEWART;LOBECK, WALTER G. (JR);YEVICH, JOSEPH P.
  作者：NEW, JAMES STEWART、LOBECK, WALTER G. (JR)、YEVICH, JOSEPH P.

  DOI：——

  日期：——
• TEMPLE, D. L. ,, JR.;YEAGER, R. E.
  作者：TEMPLE, D. L. ,, JR.、YEAGER, R. E.

  DOI：——

  日期：——
• NEW, JAMES S.;YEVICH, JOSEPH P.;TEMPLE, DAVIS L. , JR.;NEW, KIMBERLY B.;G+, J. MED. CHEM., 31,(1988) N 3, 618-624
  作者：NEW, JAMES S.、YEVICH, JOSEPH P.、TEMPLE, DAVIS L. , JR.、NEW, KIMBERLY B.、G+

  DOI：——

  日期：——