330818 <common-name>4-(4-fluorophenyl)-5-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-3h-1,3-oxazol-2-one</common-name> <description>4-(4-fluorophenyl)-5-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-3h-1,3-oxazol-2-one is a chemical compound with the formula C22H21F4N3O2. It has an average molecular weight of 435.40 g/mol.</description> <cas nil="true"/> <pubchem-id>3078366</pubchem-id> <chemical-formula>C22H21F4N3O2</chemical-formula> <weight>435.4</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">2026-08-30T11:29:57Z</created-at> <updated-at type="dateTime">2026-08-30T11:29:57Z</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>C1CN(CCN1CCC2=C(NC(=O)O2)C3=CC=C(C=C3)F)C4=CC=CC(=C4)C(F)(F)F</moldb-smiles> <moldb-formula>C22H21F4N3O2</moldb-formula> <moldb-inchi>InChI=1S/C22H21F4N3O2/c23-17-6-4-15(5-7-17)20-19(31-21(30)27-20)8-9-28-10-12-29(13-11-28)18-3-1-2-16(14-18)22(24,25)26/h1-7,14H,8-13H2,(H,27,30)</moldb-inchi> <moldb-inchikey>AFYJBMPSMJLSLL-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">435.1569896</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.2</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>CHEM326711</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>4-(4-fluorophenyl)-5-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-3h-1,3-oxazol-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>Diazinanes</klass> <subklass>Piperazines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0281362</sync-id> <structure-inchikey>AFYJBMPSMJLSLL-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2080200000200000000010000000000000002000040000000020000000002000100000000000000000010000000000000000000000800010000400000000000000000000000000002084000001001000000000000000000000000000400000000000000010000080000002010000000000000000000000000100400000000080000020000000400080000000000000000000100008000000000000040000000000000008000000224000000004000000a000000800200000000000000000000800000400000000020000000000000000004200000000010000000040000000000040000000000000800000000200000000000040000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ��������������������"���€���`�������`�������(�������`�������`������� ������`�������`������@(������@(������@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�B������������ � �������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:33:17Z</structure-indexed-at> </compound>