79205 <common-name>3-(2-Bromoethyl)quinazoline-2,4(1H,3H)-dione</common-name> <description nil="true"/> <cas>77093-96-0</cas> <pubchem-id>5743651</pubchem-id> <chemical-formula>C10H9Br1N2O2</chemical-formula> <weight nil="true"/> <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">2026-04-04T13:53:42Z</created-at> <updated-at type="dateTime">2026-04-04T13:53:42Z</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>BrCCN1C(=O)NC2=CC=CC=C2C1=O</moldb-smiles> <moldb-formula>C10H9Br1N2O2</moldb-formula> <moldb-inchi>InChI=1S/C10H9BrN2O2/c11-5-6-13-9(14)7-3-1-2-4-8(7)12-10(13)15/h1-4H,5-6H2,(H,12,15)</moldb-inchi> <moldb-inchikey>HDTBGSPQYIYDES-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">269.098</moldb-average-mass> <moldb-mono-mass type="decimal">267.98474</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>4675451</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>CHEM075098</chemdb-id> <dsstox-id>DTXSID80227874</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00037880</susdat-id> <iupac>3-(2-bromoethyl)-1H-quinazoline-2,4-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>Organoheterocyclic compounds</superklass> <klass>Diazanaphthalenes</klass> <subklass>Benzodiazines</subklass> <paper-count type="integer">2</paper-count> <sync-id>CED0052525</sync-id> <structure-inchikey>HDTBGSPQYIYDES-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000400100000000000000000000000000000000100000000000000020000000000000000000000000000000000000000000010080000000000000000000000000000000000020000000000000000000800000020000000000200000000000000000000000000000000100000000200010000000000000000000200000800000200000004004000000000100000000000000000000000010000000000000040000080000000000000000000000000000000000000000000000040000000000000000000000000000008000000000004200000001000000000000000000000040000000040000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€�#� ������`�������`������@(������@(�������(������@8�������@(������@h�������@h�������@h�������@h�������@(������@(�������(�����������������h���(���h���h���h�� h� h� �h���h�� h� �(� �h���h�B������ ������ �������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:26:29Z</structure-indexed-at> </compound>