313187 <common-name>2-[[2-chloro-4-[3-chloro-4-[methyl-(2-sulfoethyldiazenyl)amino]phenyl]-n-methylanilino]diazenyl]ethanesulfonic acid</common-name> <description>2-[[2-chloro-4-[3-chloro-4-[methyl-(2-sulfoethyldiazenyl)amino]phenyl]-n-methylanilino]diazenyl]ethanesulfonic acid has the chemical formula C18H22Cl2N6O6S2. With an average molecular weight of 553.40 g/mol, 2-[[2-chloro-4-[3-chloro-4-[methyl-(2-sulfoethyldiazenyl)amino]phenyl]-n-methylanilino]diazenyl]ethanesulfonic acid is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>109533</pubchem-id> <chemical-formula>C18H22Cl2N6O6S2</chemical-formula> <weight>553.4</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">2026-08-29T09:55:55Z</created-at> <updated-at type="dateTime">2026-08-29T09:55:55Z</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>CN(C1=C(C=C(C=C1)C2=CC(=C(C=C2)N(C)N=NCCS(=O)(=O)O)Cl)Cl)N=NCCS(=O)(=O)O</moldb-smiles> <moldb-formula>C18H22Cl2N6O6S2</moldb-formula> <moldb-inchi>InChI=1S/C18H22Cl2N6O6S2/c1-25(23-21-7-9-33(27,28)29)17-5-3-13(11-15(17)19)14-4-6-18(16(20)12-14)26(2)24-22-8-10-34(30,31)32/h3-6,11-12H,7-10H2,1-2H3,(H,27,28,29)(H,30,31,32)</moldb-inchi> <moldb-inchikey>PHGBXLFNMAXYQO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">552.0419302</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.6</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>CHEM309080</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-[[2-chloro-4-[3-chloro-4-[methyl-(2-sulfoethyldiazenyl)amino]phenyl]-n-methylanilino]diazenyl]ethanesulfonic acid</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>CED0264104</sync-id> <structure-inchikey>PHGBXLFNMAXYQO-UHFFFAOYSA-N</structure-inchikey> 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