345739 <common-name>3-[4-(1h-benzimidazol-2-yl)phenyl]-6-iodo-2-phenylquinazolin-4-one</common-name> <description>3-[4-(1h-benzimidazol-2-yl)phenyl]-6-iodo-2-phenylquinazolin-4-one is a chemical compound with the formula C27H17IN4O. With an average molecular weight of 540.40 g/mol, 3-[4-(1h-benzimidazol-2-yl)phenyl]-6-iodo-2-phenylquinazolin-4-one is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>63167</pubchem-id> <chemical-formula>C27H17IN4O</chemical-formula> <weight>540.4</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">2026-08-31T08:42:58Z</created-at> <updated-at type="dateTime">2026-08-31T08:42:58Z</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=C3)I)C(=O)N2C4=CC=C(C=C4)C5=NC6=CC=CC=C6N5</moldb-smiles> <moldb-formula>C27H17IN4O</moldb-formula> <moldb-inchi>InChI=1S/C27H17IN4O/c28-19-12-15-22-21(16-19)27(33)32(26(31-22)18-6-2-1-3-7-18)20-13-10-17(11-14-20)25-29-23-8-4-5-9-24(23)30-25/h1-16H,(H,29,30)</moldb-inchi> <moldb-inchikey>LWKYFHJBKIOKIR-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">540.04471</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>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>CHEM341632</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>3-[4-(1h-benzimidazol-2-yl)phenyl]-6-iodo-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>Benzimidazoles</klass> <subklass>Phenylbenzimidazoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0296094</sync-id> <structure-inchikey>LWKYFHJBKIOKIR-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200000000000000101000000000000080000000000004000000000000040000020000001000000002104000000000000000000400000200080000001000000000000000000000000000020040000000000000000008000000000000000000000000000000000100000800000000100100040000000000003000000000000000000804000200000002000800000000100000000000000000000000000000000000000040000080000000000000000020000000002000000000000000000000000202040000000000000000000002000002000004200000001000000080040000001000040000000000000000000000000000040000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAhAAAAJgAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAAD BAdAKAAAAAMDBkAoAAAAAwQGQCgAAAADBAZAaAAAAAMDAQZAKAAAAAMEBkBo AAAAAwMBBkBoAAAAAwMBNQAgAAAAAQZAKAAAAAMECAAoAAAAAwIHQCgAAAAD AwZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEG QGgAAAADAwEGQCgAAAADBAdAKAAAAAMDBkAoAAAAAwQGQGgAAAADAwEGQGgA AAADAwEGQGgAAAADAwEGQGgAAAADAwEGQCgAAAADBAdAOAAAAAMBAwsAAWgM AQJoDAIDaAwDBGgMBAVoDAMGIAYHaAwHCGgMCAloDAkKaAwKC2gMCwxoDAwN aAwLDgAJD2gMDxAoAg8RaAwREiASE2gMExRoDBQVaAwVFmgMFhdoDBUYIBgZ aAwZGmgMGhtoDBscaAwcHWgMHR5oDB4faAwfIGgMBQBoDBEGaAwNCGgMFxJo DCAYaAwfGmgMQgYAAAAGAAUEAwIBBgcICQ8RBgYKCwwNCAkGExQVFhcSBRkY IB8aBhscHR4fGhcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:44:41Z</structure-indexed-at> </compound>