<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">331008</id>
  <title nil="true"/>
  <common-name>3-[5-(4-chlorophenyl)furan-2-yl]-n-[2-(4-methoxyphenyl)ethyl]propanamide</common-name>
  <description>3-[5-(4-chlorophenyl)furan-2-yl]-n-[2-(4-methoxyphenyl)ethyl]propanamide is a chemical compound with the formula C22H22ClNO3. It has an average molecular weight of 383.90 g/mol.</description>
  <cas>853312-33-1</cas>
  <pubchem-id>24212549</pubchem-id>
  <chemical-formula>C22H22ClNO3</chemical-formula>
  <weight>383.9</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">2026-08-30T11:43:13Z</created-at>
  <updated-at type="dateTime">2026-08-30T11:43:13Z</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=C(C=C1)CCNC(=O)CCC2=CC=C(O2)C3=CC=C(C=C3)Cl</moldb-smiles>
  <moldb-formula>C22H22ClNO3</moldb-formula>
  <moldb-inchi>InChI=1S/C22H22ClNO3/c1-26-19-8-2-16(3-9-19)14-15-24-22(25)13-11-20-10-12-21(27-20)17-4-6-18(23)7-5-17/h2-10,12H,11,13-15H2,1H3,(H,24,25)</moldb-inchi>
  <moldb-inchikey>OEQXOFVDCCJSFI-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">383.1288213</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>CHEM326901</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>3-[5-(4-chlorophenyl)furan-2-yl]-n-[2-(4-methoxyphenyl)ethyl]propanamide</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>Phenol ethers</klass>
  <subklass>Anisoles</subklass>
  <paper-count type="integer">2</paper-count>
  <sync-id>CED0049983</sync-id>
  <structure-inchikey>OEQXOFVDCCJSFI-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800000000040000000000000000004000080000002200000000000000200200000000000000000000000000000000000000000000000000008000000400000000400000000000020801000000100000200000000000000040000010080090040000040000000800000000000000000000000000000000000040040020000000000002000000080800000000000000000001000000000000000000000000000000000080000000000000000000000000000001000000080000008000004000800000000000000000010000000004000000220000000002000000000000000000040000000000400024000000000000000000000000000</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���h�����	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:33:26Z</structure-indexed-at>
</compound>
