317625 <common-name>1-[(6,7-dimethoxy-3,4-dihydro-1h-isochromen-1-yl)methyl]-3-(3-fluorophenyl)thiourea</common-name> <description>1-[(6,7-dimethoxy-3,4-dihydro-1h-isochromen-1-yl)methyl]-3-(3-fluorophenyl)thiourea is a compound with the chemical formula C19H21FN2O3S. It has an average molecular weight of 376.40 g/mol.</description> <cas>70070-08-5</cas> <pubchem-id>3053537</pubchem-id> <chemical-formula>C19H21FN2O3S</chemical-formula> <weight>376.4</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">2026-08-29T15:48:05Z</created-at> <updated-at type="dateTime">2026-08-29T15:48:05Z</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=C(C=C2C(OCCC2=C1)CNC(=S)NC3=CC(=CC=C3)F)OC</moldb-smiles> <moldb-formula>C19H21FN2O3S</moldb-formula> <moldb-inchi>InChI=1S/C19H21FN2O3S/c1-23-16-8-12-6-7-25-18(15(12)10-17(16)24-2)11-21-19(26)22-14-5-3-4-13(20)9-14/h3-5,8-10,18H,6-7,11H2,1-2H3,(H2,21,22,26)</moldb-inchi> <moldb-inchikey>TWYSXXBAWKGJCL-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">376.1256919</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3</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>CHEM313518</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>1-[(6,7-dimethoxy-3,4-dihydro-1h-isochromen-1-yl)methyl]-3-(3-fluorophenyl)thiourea</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>Benzene and substituted derivatives</klass> <subklass>N-phenylthioureas</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0268439</sync-id> <structure-inchikey>TWYSXXBAWKGJCL-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800040020000000800000000008104010000020000400000000000000000000000040000000000000000000000000000000000000000000000000000000000000000000000000000800000000111000000200000000000000000210000200040000000100000000000020000220000000000000000101001000040000000800000000000020180000000000000000000080400000000100000000001000000000000080000000000000800000000000100000000000080000000000000000800000000000008024000000000000000200200000000000000008000000000000040000000000000800000008020000000000000200000</structure-fingerprint> 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