313956 <common-name>Ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium</common-name> <description>Ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium is a compound with the formula C18H24N3S+. It has an average molecular weight of 314.50 g/mol.</description> <cas nil="true"/> <pubchem-id>3050729</pubchem-id> <chemical-formula>C18H24N3S+</chemical-formula> <weight>314.5</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">2026-08-29T10:53:32Z</created-at> <updated-at type="dateTime">2026-08-29T10:53:32Z</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>CC[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1N=CC=C3</moldb-smiles> <moldb-formula>C18H24N3S+</moldb-formula> <moldb-inchi>InChI=1S/C18H24N3S/c1-4-21(2,3)14-8-13-20-15-9-5-6-10-16(15)22-17-11-7-12-19-18(17)20/h5-7,9-12H,4,8,13-14H2,1-3H3/q+1</moldb-inchi> <moldb-inchikey>JBTFUADMKIVFEI-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">314.169094</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.8</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>CHEM309849</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>Ethyl-dimethyl-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium</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>Organic nitrogen compounds</superklass> <klass>Organonitrogen compounds</klass> <subklass>Amines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0264855</sync-id> <structure-inchikey>JBTFUADMKIVFEI-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000800000000800200000000000000000000020000000000000000002000000000000000000002000040012002000008000000000000000000000000000000000080000000008000000000010000000000000000000000020000000000000010000000000000000000044000100040000000000000000000000100040000000800000000000004000010000000100000000000800000010000100000000000000000000080000000000000000080002000000000000000000000000000040000000000000010000000000000000000000000200000000000000000000000000002040000000010000000000000000000000000000000208</structure-fingerprint> <structure-pattern-fingerprint>513080000913824080000b45052c20000100140201052000003560428234084c4c2202501280040088406188028800018420002540ad3281002664b100a04010c6110c081a80140000901020006202000805059151411b32400405324022d0020c2804270048022046008400d5950008208680708101c0045118280402710202004402084ef882080c060240882c0068391d88124c003c0201a00c0220c14081409310040052c00102000d48017c27301ec8c0008941084010a0421008e00310801000e424c802130180800014010a8004010080020850100d0802000a000320911049900080000020000493511360000812223290c2000e0008100058000602</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAWAAAAGAAAAIABBgBgAAAAAQMGAGAAAAAC AgcgIgAAAAEEBgBgAAAAAQMGAGAAAAABAwYAYAAAAAICBgBgAAAAAgIGAGAA AAACAgcAKAAAAAMDBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAAD AwEGQGgAAAADAwEGQCgAAAADBBAAIAAAAAIGQCgAAAADBAZAKAAAAAMEB0Ao AAAAAwMGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwELAAEAAQIAAgMAAgQA AgUABQYABgcABwgACAkgCQpoDAoLaAwLDGgMDA1oDA0OaAwODwAPEAAQEWgM ERJoDBITaAwTFGgMFBVoDBEIIA4JaAwVEGgMQgMAAAAGCBEQDw4JBgoLDA0O CQYSExQVEBEXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:20:30Z</structure-indexed-at> </compound>