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Description:PotentandselectiveOX1antagoNIST
ChemicalName:(aR,1S)-1-[(3,4-Dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxy-N-(1-methylethyl)-a-phenyl-2(1H)-isoquinolineacetamide
Purity:≥98%(HPLC)
BIOLOGicalActivityTechnicalDataSolubilityCalculatorsDatasheetsReferences
BiologicalActivity
PotentandselectiveorexinOX1receptorantagonist(Kbvaluesare41and560nMforOX1andOX2receptorsrespectively).Elicitsanxiolyticeffectsinvivo.Brainpenetrantandorallyavailable.
TechnicalData
| M.Wt | 518.64 |
| Formula | C31H38N2O5 |
| Storage | Storeat-20°C |
| Purity | ≥98%(HPLC) |
| CASNumber | 1354039-86-3 |
| PubChemID | 54765113 |
| InChIKey | HXHOBPVRRPCTLG-SETSBSEESA-N |
| Smiles | O=C(NC(C)C)[C@@H]([C@]4=CC=CC=C4)N2CCC1=CC(OC)=C(OC)C=C1[C@@H]2CC3=CC(OC)=C(OC)C=C3 |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 51.86 | 100 | |
| ethanol | 51.86 | 100 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight518.64.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 1.93mL | 9.64mL | 19.28mL |
| 5mM | 0.39mL | 1.93mL | 3.86mL |
| 10mM | 0.19mL | 0.96mL | 1.93mL |
| 50mM | 0.04mL | 0.19mL | 0.39mL |
MolarityCalculator
MolarityCalculator
Calculatethemass,volume,orconcentrationrequiredforasolution.
ReconstitutionCalculator
ReconstitutionCalculator
DilutionCalculator
DilutionCalculator
Calculatethedilutionrequiredtoprepareastocksolution.
ProductDatasheets
CertificateofAnalysis/ProductDatasheet
SafetyDatasheet

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