Flucloxacillin sodiumProduct ingredient for Flucloxacillin
- Name
- Flucloxacillin sodium
- Drug Entry
- Flucloxacillin
Antibiotic analog of cloxacillin.
- Accession Number
- DBSALT000345
- Structure
Structure for Flucloxacillin sodium (DBSALT000345)
- Synonyms
- Flucloxacillin sodium monohydrate
- UNII
- LMG7C674WJ
- CAS Number
- 34214-51-2
- Weight
- Average: 493.87
Monoisotopic: 493.0486566 - Chemical Formula
- C19H18ClFN3NaO6S
- InChI Key
- PARMJFIQRZRMHG-VICXVTCVSA-M
- InChI
- InChI=1S/C19H17ClFN3O5S.Na.H2O/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24;;/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28);;1H2/q;+1;/p-1/t13-,14+,17-;;/m1../s1
- IUPAC Name
- sodium (2S,5R,6R)-6-[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-amido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrate
- SMILES
- O.[Na+].[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C1=C(C)ON=C1C1=C(Cl)C=CC=C1F)C([O-])=O
- External Links
- PubChem Compound
- 23706211
- ChemSpider
- 4445561
- ChEBI
- 52040
- ChEMBL
- CHEMBL3187256
- Predicted Properties
Property Value Source Water Solubility 0.071 mg/mL ALOGPS logP 3.15 ALOGPS logP 2.44 Chemaxon logS -3.8 ALOGPS pKa (Strongest Acidic) 3.75 Chemaxon pKa (Strongest Basic) -0.93 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 115.57 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 117.69 m3·mol-1 Chemaxon Polarizability 41.39 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon