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847553-89-3,MFCD22683843
Catalog No.:AA00GAFO

847553-89-3 | SHA 68

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1mg
≥95%
in stock  
$46.00   $32.00
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5mg
≥95%
in stock  
$126.00   $88.00
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10mg
≥95%
in stock  
$229.00   $160.00
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25mg
≥95%
in stock  
$515.00   $360.00
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00GAFO
Chemical Name:
SHA 68
CAS Number:
847553-89-3
Molecular Formula:
C26H24FN3O3
Molecular Weight:
445.4855
MDL Number:
MFCD22683843
SMILES:
Fc1ccc(cc1)CNC(=O)N1CCN2C(C1)C(OC2=O)(c1ccccc1)c1ccccc1
Properties
Computed Properties
 
Complexity:
681  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.7  

Literature

Title: Intranasally administered neuropeptide S (NPS) exerts anxiolytic effects following internalization into NPS receptor-expressing neurons.

Journal: Neuropsychopharmacology : official publication of the American College of Neuropsychopharmacology 20120501

Title: [tBu-D-Gly5]NPS, a pure and potent antagonist of the neuropeptide S receptor: in vitro and in vivo studies.

Journal: Peptides 20120401

Title: Synthesis and separation of the enantiomers of the neuropeptide S receptor antagonist (9R/S)-3-oxo-1,1-diphenyl-tetrahydro-oxazolo[3,4-a]pyrazine-7-carboxylic acid 4-fluoro-benzylamide (SHA 68).

Journal: Journal of medicinal chemistry 20110428

Title: Neuropeptide S facilitates cue-induced relapse to cocaine seeking through activation of the hypothalamic hypocretin system.

Journal: Proceedings of the National Academy of Sciences of the United States of America 20101109

Title: Further studies on the pharmacological profile of the neuropeptide S receptor antagonist SHA 68.

Journal: Peptides 20100501

Title: Importance of extracellular loop one of the neuropeptide S receptor for biogenesis and function.

Journal: Peptides 20100101

Title: Identifying structural features on 1,1-diphenyl-hexahydro-oxazolo[3,4-a]pyrazin-3-ones critical for Neuropeptide S antagonist activity.

Journal: Bioorganic & medicinal chemistry letters 20080715

Title: Synthesis and pharmacological in vitro and in vivo profile of 3-oxo-1,1-diphenyl-tetrahydro-oxazolo[3,4-a]pyrazine-7-carboxylic acid 4-fluoro-benzylamide (SHA 68), a selective antagonist of the neuropeptide S receptor.

Journal: The Journal of pharmacology and experimental therapeutics 20080601

Title: Okamura N, et al. Synthesis and pharmacological in vitro and in vivo profile of 3-oxo-1,1-diphenyl-tetrahydro-oxazolo,4-apyrazine-7-carboxylic acid 4-fluoro-benzylamide (SHA 68), a selective antagonist of the neuropeptide S receptor.J Pharmacol Exp Ther. 2008 Jun;325(3):893-901.

Title: Ensho T, et al. Neuropeptide S increases motor activity and thermogenesis in the rat through sympathetic activation.Neuropeptides. 2017 Oct;65:21-27.

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