<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">351554</id>
  <title nil="true"/>
  <common-name>1-[3-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propyl]-6-phenylpiperidin-2-one</common-name>
  <description>1-[3-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propyl]-6-phenylpiperidin-2-one is a chemical compound with the formula C31H35F2N3O. With an average molecular weight of 503.60 g/mol, 1-[3-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propyl]-6-phenylpiperidin-2-one is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>3066223</pubchem-id>
  <chemical-formula>C31H35F2N3O</chemical-formula>
  <weight>503.6</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">2026-08-31T17:19:23Z</created-at>
  <updated-at type="dateTime">2026-08-31T17:19:23Z</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>C1CC(N(C(=O)C1)CCCN2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)C5=CC=CC=C5</moldb-smiles>
  <moldb-formula>C31H35F2N3O</moldb-formula>
  <moldb-inchi>InChI=1S/C31H35F2N3O/c32-27-14-10-25(11-15-27)31(26-12-16-28(33)17-13-26)35-22-20-34(21-23-35)18-5-19-36-29(8-4-9-30(36)37)24-6-2-1-3-7-24/h1-3,6-7,10-17,29,31H,4-5,8-9,18-23H2</moldb-inchi>
  <moldb-inchikey>RVKCUBXVIDKQQO-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">503.2748191</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.3</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>CHEM347447</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-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]propyl]-6-phenylpiperidin-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>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Diphenylmethanes</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0301854</sync-id>
  <structure-inchikey>RVKCUBXVIDKQQO-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40010000000000000020802000000000000000000000000000000000010000000000000000000020000000000000000004000000000000000004404000000000000000000000000000000000000000000024000000200010000000100000000000000002080000000000000000000000000000020100000000000000000000100800000000000000800000000000004000000002000100000000000000004001000000008044000000000c0048000000200000000000000000a000000000000000000000000000000000001000000001020000000000000000200200000100010000000000000004000040000000010000800000004000000000000000000000</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������������������ ��(�����������	�	
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��������������� !"#$�����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:49:27Z</structure-indexed-at>
</compound>
