320344 <common-name>10,16-dibromo-12lambda6,14lambda6-dithia-13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 12,12,14,14-tetraoxide</common-name> <description>10,16-dibromo-12lambda6,14lambda6-dithia-13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 12,12,14,14-tetraoxide is a chemical compound with the formula C20H11Br2NO4S2. With an average molecular weight of 553.20 g/mol, 10,16-dibromo-12lambda6,14lambda6-dithia-13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 12,12,14,14-tetraoxide is a heavy molecule.</description> <cas>1245748-52-0</cas> <pubchem-id>46928544</pubchem-id> <chemical-formula>C20H11Br2NO4S2</chemical-formula> <weight>553.2</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">2026-08-29T19:12:23Z</created-at> <updated-at type="dateTime">2026-08-29T19:12:23Z</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(=C1)C=C(C3=C2C4=C(C(=CC5=CC=CC=C54)Br)S(=O)(=O)NS3(=O)=O)Br</moldb-smiles> <moldb-formula>C20H11Br2NO4S2</moldb-formula> <moldb-inchi>InChI=1S/C20H11Br2NO4S2/c21-15-9-11-5-1-3-7-13(11)17-18-14-8-4-2-6-12(14)10-16(22)20(18)29(26,27)23-28(24,25)19(15)17/h1-10,23H</moldb-inchi> <moldb-inchikey>LLIFLAJOLMQNON-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">550.84963</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.6</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>CHEM316237</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>10,16-dibromo-12lambda6,14lambda6-dithia-13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 12,12,14,14-tetraoxide</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Biphenyls and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0271092</sync-id> <structure-inchikey>LLIFLAJOLMQNON-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>10100000008000000000000000000000000000000000000000010000000000000000000000000000020000000000000000000000000000000000040000200000000000000000000000000000000000000020000000000000000000800000000000000000000000004880000000100000000000000000000000000000000000000000001000000001800000200000000000000000000100000000000000000000000000000000000000040000080000020000000000000000000000000000000000000000040000000000000100000000000000000000000000011200000000000000000000000001000040000000000000000000000000000000000040000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAdAAAAIQAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkBoAAAAAwMBBkAoAAAAAwQGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMD AQZAKAAAAAMEBkAoAAAAAwQGQCgAAAADBAZAKAAAAAMEBkAoAAAAAwQGQCgA AAADBAZAaAAAAAMDAQZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAA AwMBBkBoAAAAAwMBBkAoAAAAAwQjACAAAAABEAAgAAAABggAKAAAAAMCCAAo AAAAAwIHAGAAAAACARAAIAAAAAYIACgAAAADAggAKAAAAAMCIwAgAAAAAQsA AWgMAQJoDAIDaAwDBGgMBAVoDAQGaAwGB2gMBwhoDAgJaAwJCiAKC2gMCwxo DAwNaAwNDmgMDg9oDA8QaAwQEWgMERJoDBITaAwMFAALFQAVFggCFRcIAhUY ABgZABkaCAIZGwgCBxwABQBoDAkDaAwZCAATCmgMEw5oDEIFAAAABgAFBAMC AQYGBwgJAwQGDA0OEwoLBg8QERITDgcVCwoJCBkYFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:25:32Z</structure-indexed-at> </compound>