306262 <common-name>3-chloro-4-[(dimethylamino)methyl]-2-phenyl-1-benzofuran-5-ol</common-name> <description>3-chloro-4-[(dimethylamino)methyl]-2-phenyl-1-benzofuran-5-ol belongs to the 2-arylbenzofuran flavonoids, a class of phenylpropanoids and polyketides within the organic compounds. It has the chemical formula C17H16ClNO2 and an average molecular weight of 301.80 g/mol.</description> <cas nil="true"/> <pubchem-id>44409</pubchem-id> <chemical-formula>C17H16ClNO2</chemical-formula> <weight>301.8</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">2026-08-29T00:02:25Z</created-at> <updated-at type="dateTime">2026-08-29T00:02:25Z</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>CN(C)CC1=C(C=CC2=C1C(=C(O2)C3=CC=CC=C3)Cl)O</moldb-smiles> <moldb-formula>C17H16ClNO2</moldb-formula> <moldb-inchi>InChI=1S/C17H16ClNO2/c1-19(2)10-12-13(20)8-9-14-15(12)16(18)17(21-14)11-6-4-3-5-7-11/h3-9,20H,10H2,1-2H3</moldb-inchi> <moldb-inchikey>LFXJTSSRPKAEAD-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">301.0869564</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.1</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>CHEM302155</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-[(dimethylamino)methyl]-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>CED0257326</sync-id> <structure-inchikey>LFXJTSSRPKAEAD-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000040000000000000000000000000000000000000000000000000000000000004000000000000000000000000000010000000000000400000000000000000000008800000000800000000008000000000000000010000000000000000004000400000000000000000000000000010000000000040000000800000000000000000900000008140000000800000000000000000000000000000000000080000000000000000000000100000000000000000000000004000002900000000000000000010000000000000000200080000000000a00000000000000040000040000000000000000000008000000000082000</structure-fingerprint> <structure-pattern-fingerprint>501000100112824080080b40010820000000140001152000003520408200080c44220854128000001104410800c00000042100a5c08c32110932643000a14800c6130c001290161118901010056202000c05858151013b3248040762402051000c2824270048820060008400d4140001300680d08101c0041118202002510012004408084cf88208080602408a2c0008391c8812c49014820020080522c0008580c311001010c20006000948017c27140ac000108b41884818a0421008c80210801002a4849100130180000014150a8005210000421050300d002204080003003050461000010000004004037112200008102074b442000e0000180050000002</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAVAAAAFwAAAIABBgBgAAAAAQMHACAAAAAD BgBgAAAAAQMGAGAAAAACAgZAKAAAAAMEBkAoAAAAAwQGQGgAAAADAwEGQGgA AAADAwEGQCgAAAADBAZAKAAAAAMEBkAoAAAAAwQGQCgAAAADBAhAKAAAAAMC BkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEG QGgAAAADAwERACAAAAABCABoAAAAAwEBCwABAAECAAEDAAMEAAQFaAwFBmgM BgdoDAcIaAwICWgMCQpoDAoLaAwLDGgMCw0gDQ5oDA4PaAwPEGgMEBFoDBES aAwKEwAFFCAJBGgMDAhoDBINaAxCAwAAAAYECQgHBgUFCgkIDAsGDg8QERIN FwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:14:49Z</structure-indexed-at> </compound>