BiologicalActivity
Retinoicacidreceptor-relatedorphanreceptor(ROR)αandγinverseagonist(Kivaluesare172and111nMforRORαandRORγrespectively).DemonstratesnoactivityatRORβorLXR.SuppressesTh17celldifferentiationandcytokineexpressionandreducestheseverityofdiseaseinananimalmodelofmulitplesclerosis.
LicensingInformation
SoldunderlicensefromTheScrippsResearchInstitute.
TechnicalData
| M.Wt | 477.4 |
| Formula | C15H13F6N3O4S2 |
| Storage | Storeat+4°C |
| Purity | ≥98%(HPLC) |
| CASNumber | 1335106-03-0 |
| PubChemID | 44241473 |
| InChIKey | OZBSSKGBKHOLGA-UHFFFAOYSA-N |
| Smiles | CC1=C(S(NC2=CC=C(C(O)(C(F)(F)F)C(F)(F)F)C=C2)(=O)=O)SC(NC(C)=O)=N1 |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 47.74 | 100 | |
| ethanol | 47.74 | 100 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight477.4.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 2.09mL | 10.47mL | 20.95mL |
| 5mM | 0.42mL | 2.09mL | 4.19mL |
| 10mM | 0.21mL | 1.05mL | 2.09mL |
| 50mM | 0.04mL | 0.21mL | 0.42mL |
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