1.0 2016-05-22 05:50:04 UTC 2026-08-17 22:14:46 UTC Trifluridine SmallMolecule Trifluridine is an organic compound with the formula C10H11F3N2O5 and an average molecular weight of 296.20 g/mol. Trifluridine belongs to the pyrimidine 2'-deoxyribonucleosides, a subclass of pyrimidine nucleosides within the organic compounds. This compound is recorded as being released from healthcare, pharmaceuticals, and veterinary products, specifically acting as an antiinfective and an antineoplastic agent. Recorded exposure routes for the substance include oral and ophthalmic administration. In terms of biological activity, trifluridine interacts with two recorded protein targets, acting as an inhibitor of thymidylate synthase (TYMS) and targeting thymidylate synthase (TMP1). C10H11F3N2O5 296.1999 296.062006087 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione trifluridine 70-00-8 OC[C@H]1O[C@H](C[C@@H]1O)N1C=C(C(=O)NC1=O)C(F)(F)F InChI=1S/C10H11F3N2O5/c11-10(12,13)4-2-15(9(19)14-8(4)18)7-1-5(17)6(3-16)20-7/h2,5-7,16-17H,1,3H2,(H,14,18,19)/t5-,6+,7+/m0/s1 VSQQQLOSPVPRAZ-RRKCRQDMSA-N Organic compounds Nucleosides, nucleotides, and analogues Pyrimidine nucleosides Pyrimidine 2'-deoxyribonucleosides Pyrimidine 2'-deoxyribonucleosides Alkyl fluorides Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Hydropyrimidines Hydroxypyrimidines Organic oxides Organofluorides Organonitrogen compounds Organopnictogen compounds Oxacyclic compounds Primary alcohols Pyrimidones Secondary alcohols Tetrahydrofurans Alcohol Alkyl fluoride Alkyl halide Aromatic heteromonocyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Hydropyrimidine Hydroxypyrimidine Organic nitrogen compound Organic oxide Organic oxygen compound Organofluoride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Primary alcohol Pyrimidine Pyrimidine 2'-deoxyribonucleoside Pyrimidone Secondary alcohol Tetrahydrofuran Aromatic heteromonocyclic compounds nucleoside analogue organofluorine compound pyrimidine 2'-deoxyribonucleoside Detected and Not Quantified Trifluridine Action Pathway SMP0125899 Trifluridine Drug Metabolism Action Pathway SMP0142889 logp -0.75 logp -0.45 ALOGPS logs -1.65 ALOGPS solubility 6.69e+00 g/l ALOGPS logp -0.75 ChemAxon pka_strongest_acidic 7.6 ChemAxon pka_strongest_basic -3 ChemAxon iupac 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione ChemAxon average_mass 296.1999 ChemAxon mono_mass 296.062006087 ChemAxon smiles OC[C@H]1O[C@H](C[C@@H]1O)N1C=C(C(=O)NC1=O)C(F)(F)F ChemAxon formula C10H11F3N2O5 ChemAxon inchi InChI=1S/C10H11F3N2O5/c11-10(12,13)4-2-15(9(19)14-8(4)18)7-1-5(17)6(3-16)20-7/h2,5-7,16-17H,1,3H2,(H,14,18,19)/t5-,6+,7+/m0/s1 ChemAxon inchikey VSQQQLOSPVPRAZ-RRKCRQDMSA-N ChemAxon polar_surface_area 99.1 ChemAxon refractivity 56.34 ChemAxon polarizability 23.07 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f722631afc0> DB00432 253083 221798 BE0000324 BE0000021