350252 <common-name>7-[[4-[[4-[(2-cyanoimino-4,6-dioxo-1,3-diazinan-5-yl)diazenyl]benzoyl]amino]-2-ethoxyphenyl]diazenyl]naphthalene-1,3-disulfonic acid</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>165365889</pubchem-id> <chemical-formula>C30H23N9O10S2</chemical-formula> <weight>733.7</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">2026-08-31T15:12:37Z</created-at> <updated-at type="dateTime">2026-08-31T15:12:37Z</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>CCOC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N=NC3C(=O)NC(=NC#N)NC3=O)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)O)S(=O)(=O)O</moldb-smiles> <moldb-formula>C30H23N9O10S2</moldb-formula> <moldb-inchi>InChI=1S/C30H23N9O10S2/c1-2-49-24-13-19(33-27(40)16-3-6-18(7-4-16)36-39-26-28(41)34-30(32-15-31)35-29(26)42)9-10-23(24)38-37-20-8-5-17-11-21(50(43,44)45)14-25(22(17)12-20)51(46,47)48/h3-14,26H,2H2,1H3,(H,33,40)(H,43,44,45)(H,46,47,48)(H2,32,34,35,41,42)</moldb-inchi> <moldb-inchikey>YNIWXRTXOPEMLZ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">733.1009303</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM346145</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>7-[[4-[[4-[(2-cyanoimino-4,6-dioxo-1,3-diazinan-5-yl)diazenyl]benzoyl]amino]-2-ethoxyphenyl]diazenyl]naphthalene-1,3-disulfonic 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"/> </compound>