325127 <common-name>7,10,19,22-tetrabromo-16-hydroxy-2,13-diazapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3,6,8,10,12,15,17,19,21-decaen-5-one</common-name> <description>7,10,19,22-tetrabromo-16-hydroxy-2,13-diazapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3,6,8,10,12,15,17,19,21-decaen-5-one is a chemical compound with the formula C20H8Br4N2O2. With an average molecular weight of 627.90 g/mol, 7,10,19,22-tetrabromo-16-hydroxy-2,13-diazapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3,6,8,10,12,15,17,19,21-decaen-5-one is a heavy molecule.</description> <cas>31832-27-6</cas> <pubchem-id>3084553</pubchem-id> <chemical-formula>C20H8Br4N2O2</chemical-formula> <weight>627.9</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">2026-08-30T02:46:46Z</created-at> <updated-at type="dateTime">2026-08-30T02:46:46Z</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(=C2C=C(C3=C(C2=C1O)N=C4C=C(C5=CC(=CC(=O)C5=C4N3)Br)Br)Br)Br</moldb-smiles> <moldb-formula>C20H8Br4N2O2</moldb-formula> <moldb-inchi>InChI=1S/C20H8Br4N2O2/c21-7-3-8-11(23)6-13-19(17(8)15(28)4-7)26-18-12(24)5-9-10(22)1-2-14(27)16(9)20(18)25-13/h1-6,26-27H</moldb-inchi> <moldb-inchikey>LIWNTKATTCSPPB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">623.73193</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.4</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>CHEM321020</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>7,10,19,22-tetrabromo-16-hydroxy-2,13-diazapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3,6,8,10,12,15,17,19,21-decaen-5-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>CED0275770</sync-id> <structure-inchikey>LIWNTKATTCSPPB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000000020000000000000000040000000000000000000000000020000000000000000000000200000000000000000008000000009000000000100000040000000081000001004800000000000000000008000000000000000000000000040002000004000020000008000000000400000000000000000000000000000000400000800000000100000400000001000000000000020000000000000000021000001000000200000000000000008210042000000200000000000000000010000400000000000000800c0000000008000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€��@h�������@h�������@(������@(������@h�������@(������@(������@(������@(������@(�������h�������@(������@(������@h�������@(������@(������@h�������@(������@h�������@(�������(������@(������@(������@8������#� ����#� ����#� ����#� �������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">2026-09-19T05:29:06Z</structure-indexed-at> </compound>