317114 <common-name>3-chloro-4-(diethylaminomethyl)-2-phenyl-1-benzofuran-5-ol</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>50499</pubchem-id> <chemical-formula>C19H20ClNO2</chemical-formula> <weight>329.8</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">2026-08-29T15:06:01Z</created-at> <updated-at type="dateTime">2026-08-29T15:06:01Z</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>CCN(CC)CC1=C(C=CC2=C1C(=C(O2)C3=CC=CC=C3)Cl)O</moldb-smiles> <moldb-formula>C19H20ClNO2</moldb-formula> <moldb-inchi>InChI=1S/C19H20ClNO2/c1-3-21(4-2)12-14-15(22)10-11-16-17(14)18(20)19(23-16)13-8-6-5-7-9-13/h5-11,22H,3-4,12H2,1-2H3</moldb-inchi> <moldb-inchikey>RFQQTRPBLNKEDT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">329.1182566</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.8</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>CHEM313007</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-chloro-4-(diethylaminomethyl)-2-phenyl-1-benzofuran-5-ol</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>Phenylpropanoids and polyketides</superklass> <klass>2-arylbenzofuran flavonoids</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0267941</sync-id> <structure-inchikey>RFQQTRPBLNKEDT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000000004000000000000000000000000010000000000200000000000000000000000400000000000000000000004000001000000000000040000000000000000000000080000000000000000000800000000000000001000000000000000000c000400000000800000000000000000010000000000040000000800000000000000000800000008140000000800000000000000000000000000000000000080000000000000000000000100000000000000000000000004000002900000000000000000010000000000000000200000000000000a00000000000000040000040000000000000000000048000000000082000</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� � ��h���h���h���h���h������ ��h�� h���h�B������� ����� � �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:23:02Z</structure-indexed-at> </compound>