331715 <common-name>3-[(2r,6s,9ar)-6-phenyl-2,3,4,6,7,8,9,9a-octahydro-1h-quinolizin-2-yl]-1h-benzimidazol-2-one</common-name> <description>3-[(2r,6s,9ar)-6-phenyl-2,3,4,6,7,8,9,9a-octahydro-1h-quinolizin-2-yl]-1h-benzimidazol-2-one is a chemical compound with the formula C22H25N3O. It has an average molecular weight of 347.50 g/mol.</description> <cas nil="true"/> <pubchem-id>10066285</pubchem-id> <chemical-formula>C22H25N3O</chemical-formula> <weight>347.5</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">2026-08-30T12:38:34Z</created-at> <updated-at type="dateTime">2026-08-30T12:38:34Z</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>C1CC2CC(CCN2C(C1)C3=CC=CC=C3)N4C5=CC=CC=C5NC4=O</moldb-smiles> <moldb-formula>C22H25N3O</moldb-formula> <moldb-inchi>InChI=1S/C22H25N3O/c26-22-23-19-10-4-5-11-21(19)25(22)18-13-14-24-17(15-18)9-6-12-20(24)16-7-2-1-3-8-16/h1-5,7-8,10-11,17-18,20H,6,9,12-15H2,(H,23,26)/t17-,18-,20+/m1/s1</moldb-inchi> <moldb-inchikey>KMUYAJQKQQUKSQ-GGPKGHCWSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">347.1997624</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.8</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>CHEM327608</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-[(2r,6s,9ar)-6-phenyl-2,3,4,6,7,8,9,9a-octahydro-1h-quinolizin-2-yl]-1h-benzimidazol-2-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>Piperidines</klass> <subklass>Phenylpiperidines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0282247</sync-id> <structure-inchikey>KMUYAJQKQQUKSQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000400000000000000000100000000000000000000000000010000000000000000000020000010000000000004000000000000000000000000000000000000000000000000000000000000000020000000000000000000000000020000000000000000000001000000000800000000020100000000000010000000100800000001000000800000200000000000000000000100000008000000000801040801008004040000000020480000000000000000000000008000020000000000000000000010000000000000000001000000000000100000004200000009000000000000000000000040000000020000000000000000000040000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`������� ������`�������`������@(������@h�������@h�������@h�������@h�������@h�������@(������@(������@h�������@h�������@h�������@h�������@(������@8�������@(�������(������������������������������� �� � �h���h�� h� �h���h������h���h���h���h���h���h���h���h���(� ������ h���h���h�B������ �������������� �� �����������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:34:08Z</structure-indexed-at> </compound>