321862 <common-name>2-[4-(1,3-benzodioxol-2-ylmethyl)piperazin-1-yl]-1-(4-fluorophenyl)ethanone</common-name> <description>2-[4-(1,3-benzodioxol-2-ylmethyl)piperazin-1-yl]-1-(4-fluorophenyl)ethanone is a chemical compound with the formula C20H21FN2O3. It has an average molecular weight of 356.40 g/mol.</description> <cas>2194-75-4</cas> <pubchem-id>16611</pubchem-id> <chemical-formula>C20H21FN2O3</chemical-formula> <weight>356.4</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">2026-08-29T21:35:25Z</created-at> <updated-at type="dateTime">2026-08-29T21:35:25Z</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(CCN1CC2OC3=CC=CC=C3O2)CC(=O)C4=CC=C(C=C4)F</moldb-smiles> <moldb-formula>C20H21FN2O3</moldb-formula> <moldb-inchi>InChI=1S/C20H21FN2O3/c21-16-7-5-15(6-8-16)17(24)13-22-9-11-23(12-10-22)14-20-25-18-3-1-2-4-19(18)26-20/h1-8,20H,9-14H2</moldb-inchi> <moldb-inchikey>GDDDHZNLRSVFKC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">356.1536207</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.2</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>CHEM317755</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>2-[4-(1,3-benzodioxol-2-ylmethyl)piperazin-1-yl]-1-(4-fluorophenyl)ethanone</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>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbonyl compounds</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0272573</sync-id> <structure-inchikey>GDDDHZNLRSVFKC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20802000000000000000000000000000000000000000000000040000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000020a0000000001000000000000200000000000001000000000000000000000000080002010000000000000000020010000008000000000080000000000000000000000000010000000000000000000000000000800000000000000008400000200000000000000000c0000000000000000000200000a0000008200000000000020000044000000000000200000000010000000000000000000040000000400400800000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`������� ������`�������`�������(������@(������@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">2026-09-19T05:26:34Z</structure-indexed-at> </compound>