<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">336995</id>
  <title nil="true"/>
  <common-name>N-[4-[3-(4-benzylpiperidin-1-yl)propylsulfanyl]phenyl]acetamide</common-name>
  <description>N-[4-[3-(4-benzylpiperidin-1-yl)propylsulfanyl]phenyl]acetamide is a chemical compound with the formula C23H30N2OS. It has an average molecular weight of 382.60 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>3087541</pubchem-id>
  <chemical-formula>C23H30N2OS</chemical-formula>
  <weight>382.6</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">2026-08-30T19:40:25Z</created-at>
  <updated-at type="dateTime">2026-08-30T19:40:25Z</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>CC(=O)NC1=CC=C(C=C1)SCCCN2CCC(CC2)CC3=CC=CC=C3</moldb-smiles>
  <moldb-formula>C23H30N2OS</moldb-formula>
  <moldb-inchi>InChI=1S/C23H30N2OS/c1-19(26)24-22-8-10-23(11-9-22)27-17-5-14-25-15-12-21(13-16-25)18-20-6-3-2-4-7-20/h2-4,6-11,21H,5,12-18H2,1H3,(H,24,26)</moldb-inchi>
  <moldb-inchikey>SXCJJLHZRWFVBT-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">382.2078848</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.7</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>CHEM332888</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>N-[4-[3-(4-benzylpiperidin-1-yl)propylsulfanyl]phenyl]acetamide</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>Organoheterocyclic compounds</superklass>
  <klass>Piperidines</klass>
  <subklass>Benzylpiperidines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0287443</sync-id>
  <structure-inchikey>SXCJJLHZRWFVBT-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000400000000000080000000080000000000000000010000000000000400000000000000000000000400000000100400000000000000002000000000000000002000000000040000000000000000402400000000000000000000000000000000000081100000001040000080000000000002010000000000000000000050000000004020040080000000000000408000000200010000001000000104000000000000000400000000000008000000000000000000800000a000000000000000000000000000000000000000000000000000000000000000000220000000010000008000000000000040000000010400000000000000000000000000000000</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��
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  <structure-indexed-at type="dateTime">2026-09-19T05:38:14Z</structure-indexed-at>
</compound>
