336737 <common-name>9-[2-(3,4-dimethoxyphenyl)ethylimino]-n,7,7-trimethyl-6,8-dihydro-5h-pyrimido[4,5-b][1,4]benzothiazin-4-amine</common-name> <description>9-[2-(3,4-dimethoxyphenyl)ethylimino]-n,7,7-trimethyl-6,8-dihydro-5h-pyrimido[4,5-b][1,4]benzothiazin-4-amine is a chemical compound with the formula C23H29N5O2S. It has an average molecular weight of 439.60 g/mol.</description> <cas nil="true"/> <pubchem-id>135463972</pubchem-id> <chemical-formula>C23H29N5O2S</chemical-formula> <weight>439.6</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">2026-08-30T19:17:18Z</created-at> <updated-at type="dateTime">2026-08-30T19:17:18Z</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>CC1(CC2=C(C(=NCCC3=CC(=C(C=C3)OC)OC)C1)SC4=NC=NC(=C4N2)NC)C</moldb-smiles> <moldb-formula>C23H29N5O2S</moldb-formula> <moldb-inchi>InChI=1S/C23H29N5O2S/c1-23(2)11-15(25-9-8-14-6-7-17(29-4)18(10-14)30-5)20-16(12-23)28-19-21(24-3)26-13-27-22(19)31-20/h6-7,10,13,28H,8-9,11-12H2,1-5H3,(H,24,26,27)</moldb-inchi> <moldb-inchikey>CFLTVCLTNPRKHZ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">439.2041964</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.7</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>CHEM332630</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>9-[2-(3,4-dimethoxyphenyl)ethylimino]-n,7,7-trimethyl-6,8-dihydro-5h-pyrimido[4,5-b][1,4]benzothiazin-4-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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Methoxybenzenes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0287194</sync-id> <structure-inchikey>CFLTVCLTNPRKHZ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8002008000000008800001000000000000000000004040000000004002000000000000000020000000000008020000000000004000400000000000000000001080400000000000000001100001000800040008000000000004000010000000400000001000000000000200080000000000000000000050000000480000000000002000100200800000000000000000000014000000a0000004000000000000000100080000000000020200080000000110200000000080000000000000000000000000000000000000000800080000000220000000000000200000000000000040000000000000000000000020000000000000000008</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ��������������������"���€���`������� ������`�������(�������(�������(�������(�������`�������`������@(������@h�������@(������@(������@h�������@h��������(�������`�������(�������`�������`������� �����@(������@(������@h�������@(������@(������@(�������h��������h��������`�������`�����������������(��� ��(�������� � h� �h���h�� h� �h��� ����� ��������������h���h���h���h���h��� �� ����������� � h���h�B������������ �� � ������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:38:03Z</structure-indexed-at> </compound>