Document Detail


Thiophene bioisosteres of spirocyclic sigma receptor ligands: Relationships between substitution pattern and  receptor affinity.
MedLine Citation:
PMID:  22515405     Owner:  NLM     Status:  Publisher    
Abstract/OtherAbstract:
Based on the 6',7'-dihydrospiro[piperidine-4,4'-thieno[3,2-c]pyran] framework a series of more than 30  ligands with versatile substituents in 1-, 2'- and 6'-position has been synthesized and pharmacologically evaluated in order to find novel structure-affinity relationships. It was found that a cyclohexylmethyl residue at the piperidine N-atom instead of a benzyl moiety led to increased σ2 affinity and therefore to decreased σ1/σ2 selectivity. Small substituents (e.g. OH, OCH3, CN, CH2OH) in 6'-position adjacent to the O-atom were well tolerated by the σ1 receptor. Removal of the substituent in 6'-position resulted in very potent but unselective σ ligands (13). A broad range of substituents with various lipophilic and H-bond forming properties was introduced in 2'-position adjacent to the S-atom without loss of σ1 affinity. However, very polar and basic substituents in both 2'- and 6'-position decreased the σ1 affinity considerably. It is postulated that the electron density of the thiophene moiety has a big impact on the σ1 affinity.
Authors:
Christoph Oberdorf; Dirk Schepmann; Jose Miguel Vela; Helmut Buschmann; Joerg Holenz; Bernhard Wünsch
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Publication Detail:
Type:  JOURNAL ARTICLE     Date:  2012-4-19
Journal Detail:
Title:  Journal of medicinal chemistry     Volume:  -     ISSN:  1520-4804     ISO Abbreviation:  -     Publication Date:  2012 Apr 
Date Detail:
Created Date:  2012-4-20     Completed Date:  -     Revised Date:  -    
Medline Journal Info:
Nlm Unique ID:  9716531     Medline TA:  J Med Chem     Country:  -    
Other Details:
Languages:  ENG     Pagination:  -     Citation Subset:  -    
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