Ketobemidone oxalateProduct ingredient for Ketobemidone

Name
Ketobemidone oxalate
Drug Entry
Ketobemidone

Ketobemidone is a powerful opioid analgesic. It also has some NMDA-antagonist properties. This makes it useful for some types of pain that don't respond well to other opioids. The most commonly cited equalisation ratio for analgesic doses is 25 mg of ketobemidone hydrobromide to 60 mg of morphine hydrochloride or sulfate and circa 8 mg of ketobemidone by injection.

Accession Number
DBSALT002789
Structure
Synonyms
Not Available
UNII
Not Available
CAS Number
Not Available
Weight
Average: 337.372
Monoisotopic: 337.152537465
Chemical Formula
C17H23NO6
InChI Key
OPKJKUCDOASCBQ-UHFFFAOYSA-N
InChI
InChI=1S/C15H21NO2.C2H2O4/c1-3-14(18)15(7-9-16(2)10-8-15)12-5-4-6-13(17)11-12;3-1(4)2(5)6/h4-6,11,17H,3,7-10H2,1-2H3;(H,3,4)(H,5,6)
IUPAC Name
1-[4-(3-hydroxyphenyl)-1-methylpiperidin-4-yl]propan-1-one; oxalic acid
SMILES
OC(=O)C(O)=O.CCC(=O)C1(CCN(C)CC1)C1=CC(O)=CC=C1
ChemSpider
23316260
ChEMBL
CHEMBL259124
Predicted Properties
PropertyValueSource
Water Solubility3.01 mg/mLALOGPS
logP2.01ALOGPS
logP2.49Chemaxon
logS-1.9ALOGPS
pKa (Strongest Acidic)9.44Chemaxon
pKa (Strongest Basic)8.09Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area40.54 Å2Chemaxon
Rotatable Bond Count4Chemaxon
Refractivity73.12 m3·mol-1Chemaxon
Polarizability28.09 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon