329791 <common-name>6,8-dibromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-2-phenylquinazolin-4-one</common-name> <description>6,8-dibromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-2-phenylquinazolin-4-one is a chemical compound with the formula C22H16Br2N2O3. With an average molecular weight of 516.20 g/mol, 6,8-dibromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-2-phenylquinazolin-4-one is a heavy molecule.</description> <cas>68501-51-9</cas> <pubchem-id>63812</pubchem-id> <chemical-formula>C22H16Br2N2O3</chemical-formula> <weight>516.2</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">2026-08-30T10:12:54Z</created-at> <updated-at type="dateTime">2026-08-30T10:12:54Z</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=C1)C2=NC3=C(C=C(C=C3Br)Br)C(=O)N2CCC4=CC(=C(C=C4)O)O</moldb-smiles> <moldb-formula>C22H16Br2N2O3</moldb-formula> <moldb-inchi>InChI=1S/C22H16Br2N2O3/c23-15-11-16-20(17(24)12-15)25-21(14-4-2-1-3-5-14)26(22(16)29)9-8-13-6-7-18(27)19(28)10-13/h1-7,10-12,27-28H,8-9H2</moldb-inchi> <moldb-inchikey>YHPHMHKMZQUGMW-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">513.95277</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.2</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>CHEM325684</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>6,8-dibromo-3-[2-(3,4-dihydroxyphenyl)ethyl]-2-phenylquinazolin-4-one</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" nil="true"/> <sync-id>CED0280352</sync-id> <structure-inchikey>YHPHMHKMZQUGMW-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000008000000000000000000000400000000000000200000000000002300000000000000020040000000000000000000000002000800000000000000000000400000000000000200000000000000000008080000000000000002100c0004000000000100000000400000100000000000000000000000000000000000000800000000000004000800000000100000000001000000000040000000000000000040000080000020000000000000000100000000000000000040000000000002100000100000000800000008000002820000220040000000200000000000001000040000000000000080000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€��@h�������@h�������@h�������@(������@h�������@h�������@(������@(������@(������@(������@h�������@(������@h�������@(�����#� ����#� �����@(�������(������@(�������`�������`������@(������@h�������@(������@(������@h�������@h��������h��������h���������h���h���h���h���h��� ��h���h�� h� h� �h���h�� h� ����� �h���(���h������������h���h���h���h���h��� �� ��h���h� �h���h�B�������������� ���� �� � �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:32:31Z</structure-indexed-at> </compound>