1.0 2016-06-03 12:14:00 UTC 2026-08-25 12:26:26 UTC 4-amino-5-methoxy-N,2-dimethylbenzenesulphonamide SmallMolecule 4-amino-5-methoxy-N,2-dimethylbenzenesulphonamide is an organic compound with the formula C9H14N2O3S and an average molecular weight of 230.28 g/mol. 4-amino-5-methoxy-N,2-dimethylbenzenesulphonamide belongs to the benzenesulfonamides, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid has been identified in one recorded source: drinking water. The recorded exposure route for this substance is oral. C9H14N2O3S 230.28 230.072513493 4-amino-5-methoxy-N,2-dimethylbenzene-1-sulfonamide 4-amino-5-methoxy-N,2-dimethylbenzenesulfonamide 49564-57-0 CNS(=O)(=O)C1=C(C)C=C(N)C(OC)=C1 InChI=1S/C9H14N2O3S/c1-6-4-7(10)8(14-3)5-9(6)15(12,13)11-2/h4-5,11H,10H2,1-3H3 GWSQAGVGSHXRJK-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Benzenesulfonamides Aminobenzenesulfonamides Alkyl aryl ethers Aminophenyl ethers Aminosulfonyl compounds Aminotoluenes Anisoles Benzenesulfonyl compounds Hydrocarbon derivatives Methoxyanilines Methoxybenzenes Organic oxides Organopnictogen compounds Organosulfonamides Phenoxy compounds Primary amines Alkyl aryl ether Amine Aminobenzenesulfonamide Aminophenyl ether Aminosulfonyl compound Aminotoluene Aniline or substituted anilines Anisole Aromatic homomonocyclic compound Benzenesulfonyl group Ether Hydrocarbon derivative Methoxyaniline Methoxybenzene Organic nitrogen compound Organic oxide Organic oxygen compound Organic sulfonic acid or derivatives Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfonic acid amide Organosulfonic acid or derivatives Organosulfur compound Phenol ether Phenoxy compound Primary amine Sulfonyl Toluene Aromatic homomonocyclic compounds Detected and Not Quantified logp 0.5 logp 0.29 ALOGPS logs -1.79 ALOGPS solubility 3.74e+00 g/l ALOGPS logp 0.33 ChemAxon pka_strongest_acidic 10.93 ChemAxon pka_strongest_basic 2.67 ChemAxon iupac 4-amino-5-methoxy-N,2-dimethylbenzene-1-sulfonamide ChemAxon average_mass 230.28 ChemAxon mono_mass 230.072513493 ChemAxon smiles CNS(=O)(=O)C1=C(C)C=C(N)C(OC)=C1 ChemAxon formula C9H14N2O3S ChemAxon inchi InChI=1S/C9H14N2O3S/c1-6-4-7(10)8(14-3)5-9(6)15(12,13)11-2/h4-5,11H,10H2,1-3H3 ChemAxon inchikey GWSQAGVGSHXRJK-UHFFFAOYSA-N ChemAxon polar_surface_area 81.42 ChemAxon refractivity 59.32 ChemAxon polarizability 22.86 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7226d98f38> 170791 149318