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<compound>
  <id type="integer">335625</id>
  <title nil="true"/>
  <common-name>1'-[4-(4-fluorophenyl)-4-oxobutyl]-7-methoxyspiro[1-benzofuran-3,4'-piperidine]-2-one</common-name>
  <description>1'-[4-(4-fluorophenyl)-4-oxobutyl]-7-methoxyspiro[1-benzofuran-3,4'-piperidine]-2-one is a chemical compound with the formula C23H24FNO4. It has an average molecular weight of 397.40 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3057137</pubchem-id>
  <chemical-formula>C23H24FNO4</chemical-formula>
  <weight>397.4</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">2026-08-30T17:49:57Z</created-at>
  <updated-at type="dateTime">2026-08-30T17:49:57Z</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>COC1=CC=CC2=C1OC(=O)C23CCN(CC3)CCCC(=O)C4=CC=C(C=C4)F</moldb-smiles>
  <moldb-formula>C23H24FNO4</moldb-formula>
  <moldb-inchi>InChI=1S/C23H24FNO4/c1-28-20-6-2-4-18-21(20)29-22(27)23(18)11-14-25(15-12-23)13-3-5-19(26)16-7-9-17(24)10-8-16/h2,4,6-10H,3,5,11-15H2,1H3</moldb-inchi>
  <moldb-inchikey>KUKHGJDKAVQRTQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">397.1689364</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.5</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>CHEM331518</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-(4-fluorophenyl)-4-oxobutyl]-7-methoxyspiro[1-benzofuran-3,4'-piperidine]-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>Organic oxygen compounds</superklass>
  <klass>Organooxygen compounds</klass>
  <subklass>Carbonyl compounds</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0286094</sync-id>
  <structure-inchikey>KUKHGJDKAVQRTQ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>80200000000000000000000000000000000000000040000000000000002000000000000000020000000000000000000000000000000000000000000000000000000000000000002480000000011000080000000000000000000001000000024000000000000000000002010000000000000000000000000100006800000080000000000100400020100000040000000000000000000080020000000000000000000008400000200000000010080000a000000000000080000048000000000400200000000000020000044000000000000200000000010000200000000000000040000000010400800000000020080000000002000004</structure-fingerprint>
  <structure-pattern-fingerprint>7216402085328e4089505b648128a0001020140281052000803560408224494c5c228050138000000100410800c08010057103a5408d320104ae653980a04010c7110c081290160000901160127203000804858151211f3343040762402259041c28052f1048a20060009480ddb400492c8680508525e1443198a66002710002104402094ef8a64818060250c82c0208391d8c1244401e8ad0240c2061c0c08400d3101018b6d80202024968017c35100ac40002a941084018a04a180cc00212a01102a40490003313808480561502800c050010030450208d4022042a00030091304b1008814020110006075192a0820850263090c2040e1108920052000a02</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�B����������������	�����������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:37:18Z</structure-indexed-at>
</compound>
