313634 <common-name>2-[4-[bis(2-hydroxyethyl)amino]anilino]-5-(2-hydroxyethylamino)cyclohexa-2,5-diene-1,4-dione</common-name> <description>2-[4-[bis(2-hydroxyethyl)amino]anilino]-5-(2-hydroxyethylamino)cyclohexa-2,5-diene-1,4-dione is a chemical compound with the formula C18H23N3O5. It has an average molecular weight of 361.40 g/mol.</description> <cas>52136-25-1</cas> <pubchem-id>104094</pubchem-id> <chemical-formula>C18H23N3O5</chemical-formula> <weight>361.4</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">2026-08-29T10:29:11Z</created-at> <updated-at type="dateTime">2026-08-29T10:29:11Z</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(=CC=C1NC2=CC(=O)C(=CC2=O)NCCO)N(CCO)CCO</moldb-smiles> <moldb-formula>C18H23N3O5</moldb-formula> <moldb-inchi>InChI=1S/C18H23N3O5/c22-8-5-19-15-11-18(26)16(12-17(15)25)20-13-1-3-14(4-2-13)21(6-9-23)7-10-24/h1-4,11-12,19-20,22-24H,5-10H2</moldb-inchi> <moldb-inchikey>BZYZOJIGZUACMS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">361.1637708</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0</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>CHEM309527</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-[4-[bis(2-hydroxyethyl)amino]anilino]-5-(2-hydroxyethylamino)cyclohexa-2,5-diene-1,4-dione</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>Organic nitrogen compounds</superklass> <klass>Organonitrogen compounds</klass> <subklass>Amines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0264537</sync-id> <structure-inchikey>BZYZOJIGZUACMS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000000000000880000000000000000000000000100000002400000000000000000000024000000000000000000000000000000000000004000100000000000000000000000000020000000000020001000000000000010000010000000000010010000000010000000004000000000000000001080000000010000000000000000000400008000000000000080100000000080000000000010000000000000000000000000000000080000000080000000000000000000000000080000000000000000000000000000000000000001200000000000000200000000000000000000000000000040000000000000000001000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAaAAAAGwAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAADBAcAaAAAAAMC AQYAKAAAAAMEBgBoAAAAAwMBBgAoAAAAAwQIACgAAAADAgYAKAAAAAMEBgBo AAAAAwMBBgAoAAAAAwQIACgAAAADAgcAaAAAAAMCAQYAYAAAAAICBgBgAAAA AgIIAGAAAAABAQcAKAAAAAMDBgBgAAAAAgIGAGAAAAACAggAYAAAAAEBBgBg AAAAAgIGAGAAAAACAggAYAAAAAEBCwABaAwBAmgMAgNoDAMEaAwEBWgMBQYg BgcgBwgoAggJIAkKKAIJCyALDCgCDA0gDQ4oAgsPIA8QABARABESAAITIBMU ABQVABUWABMXABcYABgZAAUAaAwNByBCAgAAAAYABQQDAgEGCAkLDA0HFwQA AAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:20:17Z</structure-indexed-at> </compound>