<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">340046</id>
  <title nil="true"/>
  <common-name>1-[3-acetyl-4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]propan-1-one</common-name>
  <description>1-[3-acetyl-4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]phenyl]propan-1-one is a chemical compound with the formula C24H30N2O4. It has an average molecular weight of 410.50 g/mol.</description>
  <cas>79010-23-4</cas>
  <pubchem-id>3061346</pubchem-id>
  <chemical-formula>C24H30N2O4</chemical-formula>
  <weight>410.5</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">2026-08-30T23:29:21Z</created-at>
  <updated-at type="dateTime">2026-08-30T23:29:21Z</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)OCC(CN2CCN(CC2)C3=CC=CC=C3)O)C(=O)C</moldb-smiles>
  <moldb-formula>C24H30N2O4</moldb-formula>
  <moldb-inchi>InChI=1S/C24H30N2O4/c1-3-23(29)19-9-10-24(22(15-19)18(2)27)30-17-21(28)16-25-11-13-26(14-12-25)20-7-5-4-6-8-20/h4-10,15,21,28H,3,11-14,16-17H2,1-2H3</moldb-inchi>
  <moldb-inchikey>FIMGHYQSLDKORU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">410.2205574</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.7</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>CHEM335939</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-[3-acetyl-4-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]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>CED0290462</sync-id>
  <structure-inchikey>FIMGHYQSLDKORU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000020800200000200000000000000000000000000100000000000000002000000000000000000000004000100000000000000000000000800000000000000000000000400000000000020200001010100000000000000000000000000010000000000000000100000200000020100000000000000000000400000004040000008800000000000000000000000000100000000000000000000000000000000080000400000084000040000000000080000008040000800000000000000000000000000001000000000000000844000000000000200000000010800000840000000000040000000000420000000000020200100000000000200</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAeAAAAIAAAAIABBgBgAAAAAQMGAGAAAAAC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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:40:23Z</structure-indexed-at>
</compound>
