Temafloxacin hydrochlorideProduct ingredient for Temafloxacin
- Name
- Temafloxacin hydrochloride
- Drug Entry
- Temafloxacin
Temafloxacin is an antibiotic agent belonging to the fluoroquinolone drug class. It was first approved for use in the U.S. market in 1992, but was withdrawn shortly due to the reports of serious adverse reactions, such as allergic reactions and hemolyric anemia, resulting in three deaths.
- Accession Number
- DBSALT000794
- Structure
Structure for Temafloxacin hydrochloride (DBSALT000794)
- Synonyms
- Temafloxacin HCl
- UNII
- OC5IGJ7J6I
- CAS Number
- 105784-61-0
- Weight
- Average: 453.85
Monoisotopic: 453.1067037 - Chemical Formula
- C21H19ClF3N3O3
- InChI Key
- DDVJEYDLTXRYAJ-UHFFFAOYSA-N
- InChI
- InChI=1S/C21H18F3N3O3.ClH/c1-11-9-26(5-4-25-11)19-8-18-13(7-16(19)24)20(28)14(21(29)30)10-27(18)17-3-2-12(22)6-15(17)23;/h2-3,6-8,10-11,25H,4-5,9H2,1H3,(H,29,30);1H
- IUPAC Name
- 1-(2,4-difluorophenyl)-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid hydrochloride
- SMILES
- Cl.CC1CN(CCN1)C1=CC2=C(C=C1F)C(=O)C(=CN2C1=C(F)C=C(F)C=C1)C(O)=O
- External Links
- PubChem Compound
- 60021
- ChemSpider
- 54142
- ChEBI
- 77796
- ChEMBL
- CHEMBL2107495
- Predicted Properties
Property Value Source Water Solubility 0.0144 mg/mL ALOGPS logP 0.94 ALOGPS logP 1.06 Chemaxon logS -4.5 ALOGPS pKa (Strongest Acidic) 5.41 Chemaxon pKa (Strongest Basic) 8.76 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 72.88 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 104.53 m3·mol-1 Chemaxon Polarizability 39.36 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon