<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">349027</id>
  <title nil="true"/>
  <common-name>3-[1-(1h-benzimidazol-2-yl)-2-phenylethyl]-2-phenylquinazolin-4-one</common-name>
  <description>3-[1-(1h-benzimidazol-2-yl)-2-phenylethyl]-2-phenylquinazolin-4-one is a chemical compound with the formula C29H22N4O. It has an average molecular weight of 442.50 g/mol.</description>
  <cas>65925-26-0</cas>
  <pubchem-id>63808</pubchem-id>
  <chemical-formula>C29H22N4O</chemical-formula>
  <weight>442.5</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">2026-08-31T13:22:40Z</created-at>
  <updated-at type="dateTime">2026-08-31T13:22:40Z</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)CC(C2=NC3=CC=CC=C3N2)N4C(=NC5=CC=CC=C5C4=O)C6=CC=CC=C6</moldb-smiles>
  <moldb-formula>C29H22N4O</moldb-formula>
  <moldb-inchi>InChI=1S/C29H22N4O/c34-29-22-15-7-8-16-23(22)32-28(21-13-5-2-6-14-21)33(29)26(19-20-11-3-1-4-12-20)27-30-24-17-9-10-18-25(24)31-27/h1-18,26H,19H2,(H,30,31)</moldb-inchi>
  <moldb-inchikey>JDCUJSNUJBKYAC-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">442.1793613</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>CHEM344920</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-[1-(1h-benzimidazol-2-yl)-2-phenylethyl]-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>CED0299354</sync-id>
  <structure-inchikey>JDCUJSNUJBKYAC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000001800000100101000000000000000040000000000000000000000040008020000001000000002004001000000000000000000000200080000001000000002000000000000000800020000000000000000000008000000000000100000000000000004200000000000000000100000000000000000000000000000000200000804000200000000000800000000100000000000000000000000000000000000000040000080000000000000000000020000008000000000000000000040000000000000000000000000000000000002000004220020001000000000000000001000040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAiAAAAJwAAAIABBkBoAAAAAwMBBkBoAAAA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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:47:13Z</structure-indexed-at>
</compound>
