1.0 2016-05-22 03:26:50 UTC 2026-08-24 11:29:18 UTC Ethionamide SmallMolecule Ethionamide belongs to the pyridines and derivatives, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C8H10N2S and an average molecular weight of 166.24 g/mol. Ethionamide is found in or released from ten recorded sources. Within healthcare, pharmaceuticals, and veterinary products, it is utilized as a drug for the treatment of tuberculosis. Other recorded sources include indoor air via air, dust, and atmospheric transport; the preparation of malt within food, food processing, and cookware; household cleaning and consumer products such as pipe accessories, ash trays, and other smoking requisites; and electrical and electronic equipment, specifically communication cables or conductors, power cables, antennas, and video games. Exposure to the compound occurs through oral and inhalation routes. At the molecular level, ethionamide interacts with three recorded protein targets. It acts as an inhibitor or otherwise affects catalase-peroxidase (katG), enoyl-[acyl-carrier-protein] reductase [NADH] (inhA), and nuclear factor erythroid 2-related factor 2 (NFE2L2). Human Neurotoxin 2-ethylpyridine-4-carbothioamide C8H10N2S 166.243 166.05646902 2-ethylpyridine-4-carbothioamide ethionamide 536-33-4 CCC1=NC=CC(=C1)C(N)=S InChI=1S/C8H10N2S/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11) AEOCXXJPGCBFJA-UHFFFAOYSA-N Organic compounds Organoheterocyclic compounds Pyridines and derivatives Pyridines and derivatives Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Thioamides Thiocarbonyl compounds Thiocarboxylic acid amides Aromatic heteromonocyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organonitrogen compound Organopnictogen compound Organosulfur compound Pyridine Thioamide Thiocarbonyl group Thiocarboxylic acid amide Aromatic heteromonocyclic compounds pyridines thiocarboxamide Detected and Not Quantified Ethionamide Drug Metabolism Action Pathway SMP0143057 logp 1.33 logp 1.88 ALOGPS logs -2.30 ALOGPS solubility 8.39e-01 g/l ALOGPS logp 1.33 ChemAxon pka_strongest_acidic 11.89 ChemAxon pka_strongest_basic 5 ChemAxon iupac 2-ethylpyridine-4-carbothioamide ChemAxon average_mass 166.243 ChemAxon mono_mass 166.05646902 ChemAxon smiles CCC1=NC=CC(=C1)C(N)=S ChemAxon formula C8H10N2S ChemAxon inchi InChI=1S/C8H10N2S/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11) ChemAxon inchikey AEOCXXJPGCBFJA-UHFFFAOYSA-N ChemAxon polar_surface_area 38.91 ChemAxon refractivity 50.19 ChemAxon polarizability 17.99 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f722688c8a0> DB00609 2761171 2041901 BE0000466 BE0000332 BE0010121