342309 <common-name>N-[3-(propoxymethyl)isoquinolin-6-yl]-4,4a,5,10-tetrahydro-3h-[1,3]thiazino[3,4-b]isoquinolin-1-imine</common-name> <description>N-[3-(propoxymethyl)isoquinolin-6-yl]-4,4a,5,10-tetrahydro-3h-[1,3]thiazino[3,4-b]isoquinolin-1-imine is a chemical compound with the formula C25H27N3OS. It has an average molecular weight of 417.60 g/mol.</description> <cas>77195-27-8</cas> <pubchem-id>3059759</pubchem-id> <chemical-formula>C25H27N3OS</chemical-formula> <weight>417.6</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">2026-08-31T03:12:49Z</created-at> <updated-at type="dateTime">2026-08-31T03:12:49Z</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>CCCOCC1=NC=C2C=CC(=CC2=C1)N=C3N4CC5=CC=CC=C5CC4CCS3</moldb-smiles> <moldb-formula>C25H27N3OS</moldb-formula> <moldb-inchi>InChI=1S/C25H27N3OS/c1-2-10-29-17-23-13-21-12-22(8-7-19(21)15-26-23)27-25-28-16-20-6-4-3-5-18(20)14-24(28)9-11-30-25/h3-8,12-13,15,24H,2,9-11,14,16-17H2,1H3</moldb-inchi> <moldb-inchikey>KVZFMQDTBUUKAF-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">417.1874837</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5</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>CHEM338202</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>N-[3-(propoxymethyl)isoquinolin-6-yl]-4,4a,5,10-tetrahydro-3h-[1,3]thiazino[3,4-b]isoquinolin-1-imine</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>CED0292700</sync-id> <structure-inchikey>KVZFMQDTBUUKAF-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000000000080040000000000000004000000000030000001000000000000000200000000000000000000200000000000000000000000000000000000000000000000000000088000000880000000001008010000040c000040000020000420000000000000000002100000000000428100000000200000000000100000000040000000800000000000020000000000000100000000080004000000000080040004000000000000080000000020000004480000000000000000010100000000000000000000000008000000000000000008000000000200000040000000010000000003000040000000020040040020000000000080000000000000</structure-fingerprint> 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