BiologicalActivity
Potent,selectivehCCR2antagonist.ExhibitspotentantagonismagainstmonocytechemoattractantmoleculebindingtohCCR2andchemotaxisactivity(IC50valuesare3.7and4.7nMrespectively).AlsodisplaysweakhERGactivity;inhibitsthehERGpotassiumcurrent(IC50=84μM).Orallybioavailable.
TechnicalData
| M.Wt | 712.76 |
| Formula | C26H31F3N4O4.2CH4O3S |
| Storage | Storeat-20°C |
| Purity | ≥98%(HPLC) |
| CASNumber | 887401-93-6 |
| PubChemID | 11679268 |
| InChIKey | PNPNUHKICDECDH-SEBNIYPMSA-N |
| Smiles | O=C(NCC(N[C@@H]2CCN([C@H]3CC[C@](C4=CC=C(OC)N=C4)(O)CC3)C2)=O)C1=CC(C(F)(F)F)=CC=C1.CS(=O)(O)=O.CS(=O)(O)=O |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 71.28 | 100 | |
| water | 71.28 | 100 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight712.76.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 1.4mL | 7.01mL | 14.03mL |
| 5mM | 0.28mL | 1.4mL | 2.81mL |
| 10mM | 0.14mL | 0.7mL | 1.4mL |
| 50mM | 0.03mL | 0.14mL | 0.28mL |
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