79340 <common-name>Benzenesulfonamide, 3-amino-N-phenyl-</common-name> <description>Benzenesulfonamide, 3-amino-N-phenyl- belongs to the benzenesulfonamides, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C12H12N2O2S1 and an average molecular weight of 248.30 g/mol.</description> <cas>80-21-7</cas> <pubchem-id>66454</pubchem-id> <chemical-formula>C12H12N2O2S1</chemical-formula> <weight>248.3</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">2026-04-04T14:06:03Z</created-at> <updated-at type="dateTime">2026-08-18T16:37:04Z</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>NC1=CC(=CC=C1)S(=O)(=O)NC1=CC=CC=C1</moldb-smiles> <moldb-formula>C12H12N2O2S1</moldb-formula> <moldb-inchi>InChI=1S/C12H12N2O2S/c13-10-5-4-8-12(9-10)17(15,16)14-11-6-2-1-3-7-11/h1-9,14H,13H2</moldb-inchi> <moldb-inchikey>SOZFVONLAQIHRF-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">248.3</moldb-average-mass> <moldb-mono-mass type="decimal">248.061948</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.9</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>59826</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>CHEM075233</chemdb-id> <dsstox-id>DTXSID7058830</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00038066</susdat-id> <iupac>3-amino-N-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>Benzenesulfonamides</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0183001</sync-id> <structure-inchikey>SOZFVONLAQIHRF-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000000000000000000000000000000000000000000000102000000000000000000000000000001000000020000000004000000000000000000000000008200000000000000000100000000000000000120000000000001000000000100000000040000000000000000000000100080000000000000000000000000000000000001000000000000800000000000000080001000000100000000000000000200000000000000000000000000080000000000000000004000080000000000000000000000000000000000000000000000000004000000000000000200000000000000000000000000000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���h�������@(������@h�������@(������@h�������@h�������@h�������� ������(�������(�������h�������@(������@h�������@h�������@h�������@h�������@h��������� ��h���h���h���h���h��������� ��� � � ��h�� h� �h���h���h���h���h�B������������� ��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:26:34Z</structure-indexed-at> </compound>