19128 <common-name>4-Amino-2,5-dimethoxy-N-phenylbenzenesulfonamide</common-name> <description>4-Amino-2,5-dimethoxy-N-phenylbenzenesulfonamide is an organic compound with the formula C14H16N2O4S and an average molecular weight of 308.35 g/mol. 4-Amino-2,5-dimethoxy-N-phenylbenzenesulfonamide belongs to the benzenesulfonamides, a subclass of benzene and substituted derivatives within the organic compounds. It has been identified in one recorded source, specifically drinking water and water supply. The recorded exposure route for this compound is oral.</description> <cas>52298-44-9</cas> <pubchem-id>104143</pubchem-id> <chemical-formula>C14H16N2O4S</chemical-formula> <weight>308.35</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2016-05-22T04:51:08Z</created-at> <updated-at type="dateTime">2026-08-19T06:01:37Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>COC1=CC(=C(OC)C=C1N)S(=O)(=O)NC1=CC=CC=C1</moldb-smiles> <moldb-formula>C14H16N2O4S</moldb-formula> <moldb-inchi>InChI=1S/C14H16N2O4S/c1-19-12-9-14(13(20-2)8-11(12)15)21(17,18)16-10-6-4-3-5-7-10/h3-9,16H,15H2,1-2H3</moldb-inchi> <moldb-inchikey>NFYQAEPHDGXJSY-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">308.35</moldb-average-mass> <moldb-mono-mass type="decimal">308.083078177</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.7</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>94021</chemspider-id> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM018023</chemdb-id> <dsstox-id>DTXSID2044686</dsstox-id> <toxcast-id>44686</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00010111</susdat-id> <iupac>4-amino-2,5-dimethoxy-N-phenylbenzenesulfonamide</iupac> <moldb-polar-surface-area>90.65</moldb-polar-surface-area> <moldb-refractivity>80.51700000000001</moldb-refractivity> <moldb-polarizability>29.960940674206917</moldb-polarizability> <moldb-rotatable-bond-count>4</moldb-rotatable-bond-count> <moldb-acceptor-count>5</moldb-acceptor-count> <moldb-donor-count>2</moldb-donor-count> <moldb-pka-strongest-acidic>7.39037010584212</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>2.1008428332362787</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>1.55</moldb-alogps-logp> <moldb-alogps-logs>-3.31</moldb-alogps-logs> <moldb-alogps-solubility>1.51e-01 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Benzenesulfonamides</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0158577</sync-id> <structure-inchikey>NFYQAEPHDGXJSY-UHFFFAOYSA-N</structure-inchikey> 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