1.0 2010-04-08 22:09:43 UTC 2015-07-20 22:41:38 UTC FDB011593 Ceftiofur Veterinary antibacterial agent. FDA approved for treatment of respiratory disorders in beef or dairy cattle and pigs Ceftiofur is an antibiotic of the cephalosporin type (third generation), licensed for use in veterinary medicine. It was first described in 1987. It is marketed by pharmaceutical company Pfizer as Excede. Ceftiofur (inn) Ceftiofur hydrochloride Ceftiofur hydrochloride [usan] Ceftiofur sodium Ceftiofurum CM 31916 Excenel Naxcel Naxcel [veterinary] Naxcel [veterinary] (TN) U 64279 C19H17N5O7S3 523.563 523.029009993 7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[(furan-2-carbonylsulfanyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[(furan-2-carbonylsulfanyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 80370-57-6 CO\N=C(/C(=O)NC1C2SCC(CSC(=O)C3=CC=CO3)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1 InChI=1S/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11- ZBHXIWJRIFEVQY-KSEXSDGBSA-N belongs to the class of organic compounds known as cephalosporins. Cephalosporins are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof. Cephalosporins Organic compounds Organoheterocyclic compounds Lactams Beta lactams Aromatic heteropolycyclic compounds 1,3-thiazines 2,4-disubstituted thiazoles 2-amino-1,3-thiazoles Amino acids Azacyclic compounds Azetidines Carbonyl compounds Carbothioic S-esters Carboxylic acids Dialkylthioethers Furoic acid and derivatives Heteroaromatic compounds Hydrocarbon derivatives Monocarboxylic acids and derivatives N-acyl-alpha amino acids and derivatives Organic oxides Organopnictogen compounds Oxacyclic compounds Primary amines Secondary carboxylic acid amides Sulfenyl compounds Tertiary carboxylic acid amides Thioesters Thiohemiaminal derivatives 1,3-thiazol-2-amine 2,4-disubstituted 1,3-thiazole Alpha-amino acid or derivatives Amine Amino acid Amino acid or derivatives Aromatic heteropolycyclic compound Azacycle Azetidine Azole Carbonyl group Carbothioic s-ester Carboxamide group Carboxylic acid Carboxylic acid derivative Cephalosporin Dialkylthioether Furan Furoic acid or derivatives Hemithioaminal Heteroaromatic compound Hydrocarbon derivative Meta-thiazine Monocarboxylic acid or derivatives N-acyl-alpha amino acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Oxacycle Primary amine Secondary carboxylic acid amide Sulfenyl compound Tertiary carboxylic acid amide Thiazole Thiocarboxylic acid ester Thiocarboxylic acid or derivatives Thioether logp 1.22 ALOGPS logs -3.70 ALOGPS solubility 1.05e-01 g/l ALOGPS logp 0.22 ChemAxon pka_strongest_acidic 2.83 ChemAxon pka_strongest_basic 4.19 ChemAxon iupac 7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[(furan-2-carbonylsulfanyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid ChemAxon average_mass 523.563 ChemAxon mono_mass 523.029009993 ChemAxon smiles CO\N=C(/C(=O)NC1C2SCC(CSC(=O)C3=CC=CO3)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1 ChemAxon formula C19H17N5O7S3 ChemAxon inchi InChI=1S/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11- ChemAxon inchikey ZBHXIWJRIFEVQY-KSEXSDGBSA-N ChemAxon polar_surface_area 177.42 ChemAxon refractivity 124.51 ChemAxon polarizability 50.35 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 9 ChemAxon donor_count 3 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 14881 Specdb::CMs 43344 Specdb::MsMs 298909 Specdb::MsMs 298910 Specdb::MsMs 298911 Specdb::MsMs 340804 Specdb::MsMs 340805 Specdb::MsMs 340806 Specdb::MsMs 2815465 Specdb::MsMs 2815466 Specdb::MsMs 2815467 Specdb::MsMs 2893262 Specdb::MsMs 2893263 Specdb::MsMs 2893264 HMDB33533 #<Reference:0x000055ce32b35758> #<Reference:0x000055ce32b35528> #<Reference:0x000055ce32b35320>