BiologicalActivity
HighaffinityandselectiveCAIXandCAXIIinhibitor(Kivaluesare2,7,547and5600nMforCAXII,IX,IIandI,respectively).Inhibitsmigrationandproliferationofbreastcancercellsinvitro.Inhibitslungmetastasisinmicebearingbreasttumorxenografts,withoutaffectingprimarytumor.
CompoundLibraries
S4isalsoofferedaspartoftheTocriscreenPlus.FindoutmoreaboutcompoundlibrariesavailablefromTocris.
TechnicalData
| M.Wt | 335.38 |
| Formula | C15H17N3O4S |
| Storage | Storeat+4°C |
| Purity | ≥99%(HPLC) |
| CASNumber | 1330061-67-0 |
| PubChemID | 53342705 |
| InChIKey | HGVHSNXRZYOTPD-UHFFFAOYSA-N |
| Smiles | NS(OC1=CC=C(NC(NC2=CC(C)=CC(C)=C2)=O)C=C1)(=O)=O |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 33.54 | 100 | |
| ethanol | 6.71 | 20 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight335.38.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 2.98mL | 14.91mL | 29.82mL |
| 5mM | 0.6mL | 2.98mL | 5.96mL |
| 10mM | 0.3mL | 1.49mL | 2.98mL |
| 50mM | 0.06mL | 0.3mL | 0.6mL |
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