BiologicalActivity
PotentandselectiveCGRPreceptorantagonist(IC50valuesare0.03and6.4nMforhumanandratCGRPreceptorsrespectively).DisplayshighaffinityforhumanCGRPreceptors(Ki=14.4pM);exhibitsnosignificantaffinityfor75otherreceptors.
TechnicalData
| M.Wt | 869.65 |
| Formula | C38H47Br2N9O5 |
| Storage | Storeat-20°C |
| Purity | ≥95%(HPLC) |
| CASNumber | 204697-65-4 |
| PubChemID | 6918509 |
| InChIKey | ITIXDWVDFFXNEG-JHOUSYSJSA-N |
| Smiles | O=C(N[C@H](CC4=CC(Br)=C(O)C(Br)=C4)C(N[C@@H](CCCCN)C(N5CCN(C6=CC=NC=C6)CC5)=O)=O)N(CC3)CCC3N2CC1=CC=CC=C1NC2=O |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| 2eq.HCl | 43.48 | 50 | |
| DMSO | 43.48 | 50 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight869.65.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 1.15mL | 5.75mL | 11.5mL |
| 5mM | 0.23mL | 1.15mL | 2.3mL |
| 10mM | 0.11mL | 0.57mL | 1.15mL |
| 50mM | 0.02mL | 0.11mL | 0.23mL |
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