Fenoprofen calciumProduct ingredient for Fenoprofen

Name
Fenoprofen calcium
Drug Entry
Fenoprofen

An anti-inflammatory analgesic and antipyretic highly bound to plasma proteins. It is pharmacologically similar to aspirin, but causes less gastrointestinal bleeding.

Accession Number
DBSALT001038
Structure
Thumb
Synonyms
Fenoprofen calcium salt dihydrate
UNII
0X2CW1QABJ
CAS Number
53746-45-5
Weight
Average: 558.64
Monoisotopic: 558.1566588
Chemical Formula
C30H30CaO8
InChI Key
LZPBLUATTGKZBH-UHFFFAOYSA-L
InChI
InChI=1S/2C15H14O3.Ca.2H2O/c2*1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13;;;/h2*2-11H,1H3,(H,16,17);;2*1H2/q;;+2;;/p-2
IUPAC Name
calcium bis(2-(3-phenoxyphenyl)propanoate) dihydrate
SMILES
O.O.[Ca++].CC(C([O-])=O)C1=CC(OC2=CC=CC=C2)=CC=C1.CC(C([O-])=O)C1=CC(OC2=CC=CC=C2)=CC=C1
External Links
ChemSpider
58285
ChEBI
5005
ChEMBL
CHEMBL2103736
Wikipedia
Fenoprofen
Predicted Properties
PropertyValueSource
Water Solubility0.000128 mg/mLALOGPS
logP6.85ALOGPS
logP3.65ChemAxon
logS-6.6ALOGPS
pKa (Strongest Acidic)3.96ChemAxon
pKa (Strongest Basic)-3.7ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area49.36 Å2ChemAxon
Rotatable Bond Count8ChemAxon
Refractivity79.02 m3·mol-1ChemAxon
Polarizability24.94 Å3ChemAxon
Number of Rings4ChemAxon
Bioavailability1ChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon