1.0 2016-06-03 10:01:01 UTC 2026-08-21 18:14:47 UTC 1-ffmpoc, dicural, dicural, dicural, dicural, dicural, dicural, dicural, marbocyl, marbocyl SmallMolecule 1-ffmpoc, dicural, dicural, dicural, dicural, dicural, dicural, dicural, marbocyl, marbocyl belongs to the phenylquinolines, a subclass of quinolines and derivatives within the organic compounds. This organoheterocyclic compound has the chemical formula C21H19F2N3O3 and an average molecular weight of 399.40 g/mol. It is found in or released from two recorded sources: healthcare, pharmaceuticals & veterinary products (antibiotics) and drinking water & water supply (drinking water). Recorded exposure routes for this substance include oral and inhalation. C21H19F2N3O3 399.398 399.13944781 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid difloxacin 98106-17-3 CN1CCN(CC1)C1=C(F)C=C2C(=C1)N(C=C(C(O)=O)C2=O)C1=CC=C(F)C=C1 InChI=1S/C21H19F2N3O3/c1-24-6-8-25(9-7-24)19-11-18-15(10-17(19)23)20(27)16(21(28)29)12-26(18)14-4-2-13(22)3-5-14/h2-5,10-12H,6-9H2,1H3,(H,28,29) NOCJXYPHIIZEHN-UHFFFAOYSA-N Organic compounds Organoheterocyclic compounds Quinolines and derivatives Phenylquinolines Phenylquinolines Amino acids Aminoquinolines and derivatives Aryl fluorides Azacyclic compounds Carboxylic acids Dialkylarylamines Fluorobenzenes Fluoroquinolones Haloquinolines Heteroaromatic compounds Hydrocarbon derivatives Hydroquinolines Hydroquinolones Monocarboxylic acids and derivatives N-arylpiperazines N-methylpiperazines Organic oxides Organofluorides Organooxygen compounds Organopnictogen compounds Pyridinecarboxylic acids Quinoline carboxylic acids Trialkylamines Vinylogous amides 1,4-diazinane Amine Amino acid Amino acid or derivatives Aminoquinoline Aromatic heteropolycyclic compound Aryl fluoride Aryl halide Azacycle Benzenoid Carboxylic acid Carboxylic acid derivative Dialkylarylamine Dihydroquinoline Dihydroquinolone Fluorobenzene Fluoroquinolone Halobenzene Haloquinoline Heteroaromatic compound Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety N-alkylpiperazine N-arylpiperazine N-methylpiperazine Organic nitrogen compound Organic oxide Organic oxygen compound Organofluoride Organohalogen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylquinoline Piperazine Pyridine Pyridine carboxylic acid Pyridine carboxylic acid or derivatives Quinoline-3-carboxylic acid Tertiary aliphatic amine Tertiary aliphatic/aromatic amine Tertiary amine Vinylogous amide Aromatic heteropolycyclic compounds quinolines Detected and Not Quantified logp 2.36 logp 1.16 ALOGPS logs -3.50 ALOGPS solubility 1.26e-01 g/l ALOGPS logp 2.36 ChemAxon pka_strongest_acidic 5.64 ChemAxon pka_strongest_basic 6.45 ChemAxon iupac 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid ChemAxon average_mass 399.398 ChemAxon mono_mass 399.13944781 ChemAxon smiles CN1CCN(CC1)C1=C(F)C=C2C(=C1)N(C=C(C(O)=O)C2=O)C1=CC=C(F)C=C1 ChemAxon formula C21H19F2N3O3 ChemAxon inchi InChI=1S/C21H19F2N3O3/c1-24-6-8-25(9-7-24)19-11-18-15(10-17(19)23)20(27)16(21(28)29)12-26(18)14-4-2-13(22)3-5-14/h2-5,10-12H,6-9H2,1H3,(H,28,29) ChemAxon inchikey NOCJXYPHIIZEHN-UHFFFAOYSA-N ChemAxon polar_surface_area 64.09 ChemAxon refractivity 105.19 ChemAxon polarizability 39.25 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 6 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72261bda38> DB11511 40473223 50725