Ketoprofen lysineProduct ingredient for Ketoprofen
- Name
- Ketoprofen lysine
- Drug Entry
- Ketoprofen
Ketoprofen, a propionic acid derivative, is a nonsteroidal anti-inflammatory agent (NSAIA) with analgesic and antipyretic properties.
- Accession Number
- DBSALT003001
- Structure
Structure for Ketoprofen lysine (DBSALT003001)
- Synonyms
- Ketoprofen lysine salt
- UNII
- 5WD00E3D4C
- CAS Number
- 57469-78-0
- Weight
- Average: 400.475
Monoisotopic: 400.19982201 - Chemical Formula
- C22H28N2O5
- InChI Key
- VHIORVCHBUEWEP-ZSCHJXSPSA-N
- InChI
- InChI=1S/C16H14O3.C6H14N2O2/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12;7-4-2-1-3-5(8)6(9)10/h2-11H,1H3,(H,18,19);5H,1-4,7-8H2,(H,9,10)/t;5-/m.0/s1
- IUPAC Name
- (2S)-2,6-diaminohexanoic acid; 2-(3-benzoylphenyl)propanoic acid
- SMILES
- NCCCC[C@H](N)C(O)=O.CC(C(O)=O)C1=CC=CC(=C1)C(=O)C1=CC=CC=C1
- External Links
- ChemSpider
- 7998062
- Predicted Properties
Property Value Source Water Solubility 0.0213 mg/mL ALOGPS logP 3.29 ALOGPS logP 3.61 Chemaxon logS -4.1 ALOGPS pKa (Strongest Acidic) 3.88 Chemaxon pKa (Strongest Basic) -7.5 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 54.37 Å2 Chemaxon Rotatable Bond Count 9 Chemaxon Refractivity 72.52 m3·mol-1 Chemaxon Polarizability 26.69 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon