340132 <common-name>3-[3-chloro-5-[3-(dimethylamino)propoxy]benzo[b][1]benzothiepin-6-yl]-n,n-dimethylpropan-1-amine</common-name> <description>3-[3-chloro-5-[3-(dimethylamino)propoxy]benzo[b][1]benzothiepin-6-yl]-n,n-dimethylpropan-1-amine is a chemical compound with the formula C24H31ClN2OS. It has an average molecular weight of 431.00 g/mol.</description> <cas nil="true"/> <pubchem-id>35928</pubchem-id> <chemical-formula>C24H31ClN2OS</chemical-formula> <weight>431</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">2026-08-30T23:36:33Z</created-at> <updated-at type="dateTime">2026-08-30T23:36:33Z</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)CCCC1=C(C2=C(C=CC(=C2)Cl)SC3=CC=CC=C31)OCCCN(C)C</moldb-smiles> <moldb-formula>C24H31ClN2OS</moldb-formula> <moldb-inchi>InChI=1S/C24H31ClN2OS/c1-26(2)14-7-10-20-19-9-5-6-11-22(19)29-23-13-12-18(25)17-21(23)24(20)28-16-8-15-27(3)4/h5-6,9,11-13,17H,7-8,10,14-16H2,1-4H3</moldb-inchi> <moldb-inchikey>QFWCLFOFPDAOAL-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">430.1845625</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.4</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>CHEM336025</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-[3-chloro-5-[3-(dimethylamino)propoxy]benzo[b][1]benzothiepin-6-yl]-n,n-dimethylpropan-1-amine</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>Organoheterocyclic compounds</superklass> <klass>Benzothiepins</klass> <subklass>Dibenzothiepins</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0290548</sync-id> <structure-inchikey>QFWCLFOFPDAOAL-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000000000080000000000000000000040000000000008000000000000000000000004000000000800000000004000000000000000020000000000000000000000040000010000000000000000800001000050000000000008000000000000000008000001000000010420000000000000024000000008000000000000000004000000080800000000000000010000000010000020000100000000000000000000000000000000008000000000000000008000000000000000000000000000000014000000000000000000000001000000000000200020000800000000000000000000000004000000001000000000100000000000000000000000a</structure-fingerprint> 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