336628 <common-name>1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]butan-1-one</common-name> <description>1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]butan-1-one is a chemical compound with the formula C23H29ClN2O2. It has an average molecular weight of 400.90 g/mol.</description> <cas nil="true"/> <pubchem-id>210395</pubchem-id> <chemical-formula>C23H29ClN2O2</chemical-formula> <weight>400.9</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">2026-08-30T19:09:39Z</created-at> <updated-at type="dateTime">2026-08-30T19:09:39Z</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>COC(CN1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3</moldb-smiles> <moldb-formula>C23H29ClN2O2</moldb-formula> <moldb-inchi>InChI=1S/C23H29ClN2O2/c1-28-23(20-6-3-2-4-7-20)18-26-16-14-25(15-17-26)13-5-8-22(27)19-9-11-21(24)12-10-19/h2-4,6-7,9-12,23H,5,8,13-18H2,1H3</moldb-inchi> <moldb-inchikey>OFGVQQCZNGFVIK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">400.1917559</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>CHEM332521</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>1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]butan-1-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>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbonyl compounds</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0287088</sync-id> <structure-inchikey>OFGVQQCZNGFVIK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000000000002080000000000000000000000000000000008000000000000000000000000000000000000000000400000000000000000000000000000000100000000040000000000000000000002400000000010000000000000000000000000001008000004000000000010000000002010000000000000000000000000000006002000080000000000000400000000000010000000000000000000000000000000000000100040008400000000000000010000000a040000000000000000008000400000000200000000000000010044000200000000200400000010000000000000000000040000000010420000000000010000000000000000004</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���h�B��������� �������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:37:59Z</structure-indexed-at> </compound>