<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">291928</id>
  <title nil="true"/>
  <common-name>5-phenyl-2-piperidin-1-yl-1,3-thiazol-4-one</common-name>
  <description>5-phenyl-2-piperidin-1-yl-1,3-thiazol-4-one belongs to the piperidines, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C14H16N2OS and an average molecular weight of 260.36 g/mol.</description>
  <cas>50871-34-6</cas>
  <pubchem-id>3039606</pubchem-id>
  <chemical-formula>C14H16N2OS</chemical-formula>
  <weight>260.36</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">2026-08-28T07:08:59Z</created-at>
  <updated-at type="dateTime">2026-08-28T07:08:59Z</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>C1CCN(CC1)C2=NC(=O)C(S2)C3=CC=CC=C3</moldb-smiles>
  <moldb-formula>C14H16N2OS</moldb-formula>
  <moldb-inchi>InChI=1S/C14H16N2OS/c17-13-12(11-7-3-1-4-8-11)18-14(15-13)16-9-5-2-6-10-16/h1,3-4,7-8,12H,2,5-6,9-10H2</moldb-inchi>
  <moldb-inchikey>NIBLTJOIXAMXHR-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">260.0983343</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.9</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>CHEM287821</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>5-phenyl-2-piperidin-1-yl-1,3-thiazol-4-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>Organoheterocyclic compounds</superklass>
  <klass>Piperidines</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0243497</sync-id>
  <structure-inchikey>NIBLTJOIXAMXHR-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000000000000000000000000000000000000000000020000000000000000000000008000000020000000000000002004000100000000000000000000000000000800000000000000000000000000000020000010800000000000000000000002000000000000000000000000000000000000030100000000002000000000100800000000000000800000000000000000000000000100000000000000000001000000000000000000000000080000000010000010000000008000000000000000000000000000000000000000000001000000000000100000000200000000000000000000000000000040000000000800000000000000000002800000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������(�������`�������`�������(�������(�������(�������(�������`������� �����@(������@h�������@h�������@h�������@h�������@h������������������������ ��(��� �	(��
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  <structure-indexed-at type="dateTime">2026-09-19T05:04:11Z</structure-indexed-at>
</compound>
