Delafloxacin meglumineProduct ingredient for Delafloxacin
- Name
- Delafloxacin meglumine
- Drug Entry
- Delafloxacin
Delafloxacin is a fluoroquinolone antibiotic which has been used in trials studying the treatment and basic science of Gonorrhea, Hepatic Impairment, Bacterial Skin Diseases, Skin Structure Infections, and Community Acquired Pneumonia, among others. It was approved in June 2017 under the trade name Baxdela for use in the treatment of acute bacterial skin and skin structure infections.
- Accession Number
- DBSALT002486
- Structure
- Synonyms
- Not Available
- UNII
- N7V53U4U4T
- CAS Number
- 352458-37-8
- Weight
- Average: 635.98
Monoisotopic: 635.1605897 - Chemical Formula
- C25H29ClF3N5O9
- InChI Key
- AHJGUEMIZPMAMR-WZTVWXICSA-N
- InChI
- InChI=1S/C18H12ClF3N4O4.C7H17NO5/c19-12-13-7(1-9(20)14(12)25-3-6(27)4-25)15(28)8(18(29)30)5-26(13)17-11(22)2-10(21)16(23)24-17;1-8-2-4(10)6(12)7(13)5(11)3-9/h1-2,5-6,27H,3-4H2,(H2,23,24)(H,29,30);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1
- IUPAC Name
- (2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol; 1-(6-amino-3,5-difluoropyridin-2-yl)-8-chloro-6-fluoro-7-(3-hydroxyazetidin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
- SMILES
- CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.NC1=C(F)C=C(F)C(=N1)N1C=C(C(O)=O)C(=O)C2=C1C(Cl)=C(N1CC(O)C1)C(F)=C2
- External Links
- ChemSpider
- 9752981
- ChEMBL
- CHEMBL2105638
- Wikipedia
- Delafloxacin
- Predicted Properties
Property Value Source Water Solubility 0.0699 mg/mL ALOGPS logP 1.67 ALOGPS logP 2.56 Chemaxon logS -3.8 ALOGPS pKa (Strongest Acidic) 5.62 Chemaxon pKa (Strongest Basic) -1.3 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 8 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 119.99 Å2 Chemaxon Rotatable Bond Count 9 Chemaxon Refractivity 101.33 m3·mol-1 Chemaxon Polarizability 38.13 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon