331881 <common-name>2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(5-phenylthiophen-2-yl)ethanol</common-name> <description>2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(5-phenylthiophen-2-yl)ethanol is a compound with the formula C22H25NO3S. It has an average molecular weight of 383.50 g/mol.</description> <cas nil="true"/> <pubchem-id>3042162</pubchem-id> <chemical-formula>C22H25NO3S</chemical-formula> <weight>383.5</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">2026-08-30T12:52:55Z</created-at> <updated-at type="dateTime">2026-08-30T12:52:55Z</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=C(C=C1)CCNCC(C2=CC=C(S2)C3=CC=CC=C3)O)OC</moldb-smiles> <moldb-formula>C22H25NO3S</moldb-formula> <moldb-inchi>InChI=1S/C22H25NO3S/c1-25-19-9-8-16(14-20(19)26-2)12-13-23-15-18(24)22-11-10-21(27-22)17-6-4-3-5-7-17/h3-11,14,18,23-24H,12-13,15H2,1-2H3</moldb-inchi> <moldb-inchikey>PNPGOQVVTHNACR-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">383.1555148</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.9</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>CHEM327774</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>2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(5-phenylthiophen-2-yl)ethanol</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>Methoxybenzenes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0282412</sync-id> <structure-inchikey>PNPGOQVVTHNACR-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000020000800200800000000800002000020000000000100000400000000104000200000000000000000004000000000000000000000000000000000000000000000000000002000000000000001010000100000000008010000000000000010000000040000000100000000000000000000000000000000800001001000040080000800000000000000080804000000100000000001400100000000000000000000000002000080000000000000000000000000000001000000080000000000200000000000000000000000000001000000000000220000000000000000000000000000040000000000000000000000020000020000000000000</structure-fingerprint> 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