348639 <common-name>4-n-[2-(benzylsulfanylmethyl)-5,8-dimethoxyquinolin-6-yl]-1-n,1-n-diethylpentane-1,4-diamine</common-name> <description>4-n-[2-(benzylsulfanylmethyl)-5,8-dimethoxyquinolin-6-yl]-1-n,1-n-diethylpentane-1,4-diamine is a chemical compound with the formula C28H39N3O2S. It has an average molecular weight of 481.70 g/mol.</description> <cas>64260-40-8</cas> <pubchem-id>3049023</pubchem-id> <chemical-formula>C28H39N3O2S</chemical-formula> <weight>481.7</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">2026-08-31T12:44:15Z</created-at> <updated-at type="dateTime">2026-08-31T12:44:15Z</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)CCCC(C)NC1=CC(=C2C(=C1OC)C=CC(=N2)CSCC3=CC=CC=C3)OC</moldb-smiles> <moldb-formula>C28H39N3O2S</moldb-formula> <moldb-inchi>InChI=1S/C28H39N3O2S/c1-6-31(7-2)17-11-12-21(3)29-25-18-26(32-4)27-24(28(25)33-5)16-15-23(30-27)20-34-19-22-13-9-8-10-14-22/h8-10,13-16,18,21,29H,6-7,11-12,17,19-20H2,1-5H3</moldb-inchi> <moldb-inchikey>PUECULBPRASWBG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">481.2762987</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6</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>CHEM344532</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>4-n-[2-(benzylsulfanylmethyl)-5,8-dimethoxyquinolin-6-yl]-1-n,1-n-diethylpentane-1,4-diamine</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>Quinolines and derivatives</klass> <subklass>Aminoquinolines and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0298969</sync-id> <structure-inchikey>PUECULBPRASWBG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000800000000000000000000000000000000500000401002000000400400800000002005000000000000000000000000000080000000000000000000000000010900000000000210012100000008001000003000000000000000000040000000104000000000000800004000000000000000000000000040200000800000000000000080000000000110000080000000000000000000000000000000040000080000000000000000000008000001000000000080000800000400010000000000000000200400000000000804000220000000000000000000000001000040000000010000000001000020040000000020000000</structure-fingerprint> 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