332730 <common-name>1-[4-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]phenyl]propan-1-one</common-name> <description>1-[4-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]phenyl]propan-1-one is a compound with the formula C22H28N2OS. It has an average molecular weight of 368.50 g/mol.</description> <cas nil="true"/> <pubchem-id>3050222</pubchem-id> <chemical-formula>C22H28N2OS</chemical-formula> <weight>368.5</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">2026-08-30T13:56:55Z</created-at> <updated-at type="dateTime">2026-08-30T13:56:55Z</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>CCC(=O)C1=CC=C(C=C1)SCCCN2CCN(CC2)C3=CC=CC=C3</moldb-smiles> <moldb-formula>C22H28N2OS</moldb-formula> <moldb-inchi>InChI=1S/C22H28N2OS/c1-2-22(25)19-9-11-21(12-10-19)26-18-6-13-23-14-16-24(17-15-23)20-7-4-3-5-8-20/h3-5,7-12H,2,6,13-18H2,1H3</moldb-inchi> <moldb-inchikey>QYCHGXIELFZKIJ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">368.1922347</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.6</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>CHEM328623</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-[3-(4-phenylpiperazin-1-yl)propylsulfanyl]phenyl]propan-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>CED0283233</sync-id> <structure-inchikey>QYCHGXIELFZKIJ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000000002080000000080000000000000000000000000000000000000000000200000000000400000000100400010000000000000000000000000000000000000000000000000000000000402400000001000000000000000000000000000001100000000000000000000020000002010000000000000000000000000000404000000080000000000000400000000200010000001000000100000000000000000000000000000008400004000000000000000000a000000800000000000000000000000000200000000000000000844000000000000200000000010800000040000000000040000000010400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAaAAAAHAAAAIABBgBgAAAAAQMGAGAAAAAC AgYAKAAAAAMECAAoAAAAAwIGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZA KAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBEAAgAAAAAgYAYAAAAAICBgBgAAAA AgIGAGAAAAACAgcAIAAAAAMGAGAAAAACAgYAYAAAAAICBwAoAAAAAwMGAGAA AAACAgYAYAAAAAICBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAAD AwEGQGgAAAADAwEGQGgAAAADAwELAAEAAQIAAgMoAgIEIAQFaAwFBmgMBgdo DAcIaAwICWgMBwoACgsACwwADA0ADQ4ADg8ADxAAEBEAERIAEhMAERQgFBVo DBUWaAwWF2gMFxhoDBgZaAwJBGgMEw4AGRRoDEIDAAAABgQJCAcGBQYPEBES Ew4GFRYXGBkUFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:34:58Z</structure-indexed-at> </compound>