287226 <common-name>2-methyl-6-phenylbenzenesulfonamide</common-name> <description>2-methyl-6-phenylbenzenesulfonamide belongs to the biphenyls and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. It has the chemical formula C13H13NO2S and an average molecular weight of 247.31 g/mol. It is further classified as part of the benzenoids superclass.</description> <cas>1872279-93-0</cas> <pubchem-id>118598398</pubchem-id> <chemical-formula>C13H13NO2S</chemical-formula> <weight>247.31</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">2026-08-27T23:36:17Z</created-at> <updated-at type="dateTime">2026-08-27T23:36:17Z</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>CC1=C(C(=CC=C1)C2=CC=CC=C2)S(=O)(=O)N</moldb-smiles> <moldb-formula>C13H13NO2S</moldb-formula> <moldb-inchi>InChI=1S/C13H13NO2S/c1-10-6-5-9-12(13(10)17(14,15)16)11-7-3-2-4-8-11/h2-9H,1H3,(H2,14,15,16)</moldb-inchi> <moldb-inchikey>HJRUFJKWRVTNDE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">247.0666998</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.5</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <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>CHEM283119</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>2-methyl-6-phenylbenzenesulfonamide</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Biphenyls and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0239008</sync-id> <structure-inchikey>HJRUFJKWRVTNDE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000000000000000000000000000000028000000004000000000000000100000000000000000000000000000000000000000000000020000000000000000000008000000000000000000000004000000000000000000000000000000000000080000000040001000040000000800000000000000000801000000100000000000000000000000000000000000000000000080100000000000000000000080000000000000000000000000000000100000000000000000000000000002400000200000000000000000000000000000440000000000020000000000000000001000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAARAAAAEgAAAIABBgBgAAAAAQMGQCgAAAAD BAZAKAAAAAMEBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEG QCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZA aAAAAAMDARAAIAAAAAYIACgAAAADAggAKAAAAAMCBwBgAAAAAQILAAEAAQJo DAIDaAwDBGgMBAVoDAUGaAwDByAHCGgMCAloDAkKaAwKC2gMCwxoDAINAA0O CAINDwgCDRAABgFoDAwHaAxCAgAAAAYBBgUEAwIGCAkKCwwHFwQAAAAAAAAA Fg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:00:39Z</structure-indexed-at> </compound>