334453 <common-name>5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-[[(z)-[(2-hydroxy-3,5-disulfophenyl)diazenyl]-(6-sulfocyclohexa-2,4-dien-1-ylidene)methyl]diazenyl]benzoic acid</common-name> <description>5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-[[(z)-[(2-hydroxy-3,5-disulfophenyl)diazenyl]-(6-sulfocyclohexa-2,4-dien-1-ylidene)methyl]diazenyl]benzoic acid is a chemical compound with the formula C23H18ClN9O12S3. With an average molecular weight of 744.10 g/mol, 5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-[[(z)-[(2-hydroxy-3,5-disulfophenyl)diazenyl]-(6-sulfocyclohexa-2,4-dien-1-ylidene)methyl]diazenyl]benzoic acid is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>165359876</pubchem-id> <chemical-formula>C23H18ClN9O12S3</chemical-formula> <weight>744.1</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">2026-08-30T16:09:40Z</created-at> <updated-at type="dateTime">2026-08-30T16:09:40Z</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>C1=CC(C(=C(N=NC2=C(C=C(C=C2)NC3=NC(=NC(=N3)N)Cl)C(=O)O)N=NC4=C(C(=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)O)C=C1)S(=O)(=O)O</moldb-smiles> <moldb-formula>C23H18ClN9O12S3</moldb-formula> <moldb-inchi>InChI=1S/C23H18ClN9O12S3/c24-21-27-22(25)29-23(28-21)26-10-5-6-14(13(7-10)20(35)36)30-32-19(12-3-1-2-4-16(12)47(40,41)42)33-31-15-8-11(46(37,38)39)9-17(18(15)34)48(43,44)45/h1-9,16,34H,(H,35,36)(H,37,38,39)(H,40,41,42)(H,43,44,45)(H3,25,26,27,28,29)/b19-12-,32-30?,33-31?</moldb-inchi> <moldb-inchikey>GHTJMUCODCMEDM-KFWXRUBPSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">742.9925583</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.9</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>CHEM330346</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>5-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-[[(z)-[(2-hydroxy-3,5-disulfophenyl)diazenyl]-(6-sulfocyclohexa-2,4-dien-1-ylidene)methyl]diazenyl]benzoic 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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0284930</sync-id> <structure-inchikey>GHTJMUCODCMEDM-UHFFFAOYSA-N</structure-inchikey> 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