319752 <common-name>4-n-heptyl-7,7-dimethyl-6,8-dihydropyrimido[4,5-b][1,4]benzothiazine-4,9-diamine</common-name> <description>4-n-heptyl-7,7-dimethyl-6,8-dihydropyrimido[4,5-b][1,4]benzothiazine-4,9-diamine is a compound with the chemical formula C19H29N5S. It has an average molecular weight of 359.50 g/mol.</description> <cas nil="true"/> <pubchem-id>24845121</pubchem-id> <chemical-formula>C19H29N5S</chemical-formula> <weight>359.5</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">2026-08-29T18:27:04Z</created-at> <updated-at type="dateTime">2026-08-29T18:27:04Z</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>CCCCCCCNC1=C2C(=NC=N1)SC3=C(CC(CC3=N2)(C)C)N</moldb-smiles> <moldb-formula>C19H29N5S</moldb-formula> <moldb-inchi>InChI=1S/C19H29N5S/c1-4-5-6-7-8-9-21-17-15-18(23-12-22-17)25-16-13(20)10-19(2,3)11-14(16)24-15/h12H,4-11,20H2,1-3H3,(H,21,22,23)</moldb-inchi> <moldb-inchikey>DFPVOTZMYIJEHH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">359.2143671</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.6</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>CHEM315645</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-heptyl-7,7-dimethyl-6,8-dihydropyrimido[4,5-b][1,4]benzothiazine-4,9-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>Organosulfur compounds</superklass> <klass>Thioethers</klass> <subklass>Aryl thioethers</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0270521</sync-id> <structure-inchikey>DFPVOTZMYIJEHH-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>900000000000000000000000000000000000040000000000000002000040000000000000002000000000200002000000000000400400000000000000000000018040000000000000021010000000080000040000000000000020001000000000000000000000000000030008000080000001000000000000000048100000000000000000010080201000000000000000000000000020000004000001000000000100080000000080000108084000000100000000000000000000000000000000000000000000000000000000000000000000000000000000200000000000000040000000010000000000000008000000000000000008</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAZAAAAGwAAAIABBgBgAAAAAQMGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIHAGgA AAADAgEGQCgAAAADBAZAKAAAAAMEBkAoAAAAAwQHQCgAAAADAwZAaAAAAAMD AQdAKAAAAAMDEAAgAAAAAgYAKAAAAAMEBgAoAAAAAwQGAGAAAAACAgYAIAAA AAQGAGAAAAACAgYAKAAAAAMEBwAoAAAAAwMGAGAAAAABAwYAYAAAAAEDBwBo AAAAAwECCwABAAECAAIDAAMEAAQFAAUGAAYHAAcIIAgJaAwJCmgMCgtoDAsM aAwMDWgMCg4ADg8ADxAoAhARABESABITABMUABQVKAISFgASFwAQGCANCGgM FQkgFA8gQgMAAAAGCA0MCwoJBg4PFBUJCgYQERITFA8XBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:25:02Z</structure-indexed-at> </compound>