Basic information
- CAS
141725-88-4- Standard SMILES
C[C@H]1[C@H](N)CN1c1cc2c(cc1F)c(=O)c(C(=O)O)cn2-c1ccc(F)cc1F- InChIKey
LTDOHCZUKCZDEQ-BJOHPYRUSA-N- Molecular formula
- C20H16F3N3O3
- Average molar mass
- 403.4 g/mol
- Monoisotopic mass
- 403.11437587
Overview
has activity against gram-negative & some gram-positive bacteria; structure given in first source
Names & identifiers
- Preferred name
- Cetefloxacin
- IUPAC
- 7-[(2S,3R)-3-amino-2-methylazetidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxoquinoline-3-carboxylic acid
- English name
- Cetefloxacin
- Molecular formula
- C20H16F3N3O3
- Molecular weight
- 403.35
Names & synonyms
Cetefloxacin141725-88-4cetefloxacineCFY01MZD5TE-4868cetefloxacinoE 48687-[(2S,3R)-3-amino-2-methylazetidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxoquinoline-3-carboxylic acidDTXSID301618103-Quinolinecarboxylic acid, 7-(3-amino-2-methyl-1-azetidinyl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-, (2S-trans)-cetefloxacinum7-((2S,3R)-3-amino-2-methylazetidin-1-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxoquinoline-3-carboxylic acid
Show more names
Cetefloxacin USP/EP/BP3-Quinolinecarboxylic acid, 7-[(2S,3R)-3-amino-2-methyl-1-azetidinyl]-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-
RefChem:124687DTXCID00843017(3-(R)-amino-2-(S)-methyl-1-azetidinyl)-1-(2,4-difluorophenyl)-1,4-dihydro-6-fluoro-4-oxo-3-quinolinecarboxylic acidCetefloxacin [INN]UNII-CFY01MZD5T7-(3-amino-2-methyl-1-azetidinyl)-1-(2,4-difluorophenyl)-1,4-dihydro-6-fluoro-4-oxo-3-quinolinecarboxylic acid(-)-7-((2S,3R)-3-Amino-2-methyl-1-azetidinyl)-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid7-[(2s,3r)-3-amino-2-methylazetidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 720
Physicochemical properties
- Boiling point
- 592 · 592.0±50.0 °C(Predicted)
- Density
- 1.502 · 1.502±0.06 g/cm3(Predicted)
- pka
- 6.02 · 6.02±0.41(Predicted)
- FDA UNII
- 1 MZD5T · CFY01MZD5T
Chemistry & industry
Applications
UsesCetefloxacin (E 4868) is a board-spectrum antibacterial antibiotic, MIC of 0.007-8 μg/ml. Cetefloxacin exhibits good pharmacokinetic characters in mice. Cetefloxacin exhibits protective effects against Escherichia coli, Pseudomonas aeruginosa, Staphylococcus aureus, and Streptococcus pneumoniae in mice[1].
Suppliers4 total
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Related reactions
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Compound notes
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