329204 <common-name>4-n-[2-[di(propan-2-yl)amino]ethyl]-6-methoxy-2-n-methyl-5-methylsulfanyl-2-n-phenylpyrimidine-2,4-diamine</common-name> <description>4-n-[2-[di(propan-2-yl)amino]ethyl]-6-methoxy-2-n-methyl-5-methylsulfanyl-2-n-phenylpyrimidine-2,4-diamine is a compound with the chemical formula C21H33N5OS. It has an average molecular weight of 403.60 g/mol.</description> <cas nil="true"/> <pubchem-id>3043436</pubchem-id> <chemical-formula>C21H33N5OS</chemical-formula> <weight>403.6</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">2026-08-30T09:20:07Z</created-at> <updated-at type="dateTime">2026-08-30T09:20:07Z</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(C)N(CCNC1=C(C(=NC(=N1)N(C)C2=CC=CC=C2)OC)SC)C(C)C</moldb-smiles> <moldb-formula>C21H33N5OS</moldb-formula> <moldb-inchi>InChI=1S/C21H33N5OS/c1-15(2)26(16(3)4)14-13-22-19-18(28-7)20(27-6)24-21(23-19)25(5)17-11-9-8-10-12-17/h8-12,15-16H,13-14H2,1-7H3,(H,22,23,24)</moldb-inchi> <moldb-inchikey>CUDVFMRMTXRIGP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">403.2405819</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>CHEM325097</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-[di(propan-2-yl)amino]ethyl]-6-methoxy-2-n-methyl-5-methylsulfanyl-2-n-phenylpyrimidine-2,4-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>Organic nitrogen compounds</superklass> <klass>Organonitrogen compounds</klass> <subklass>Amines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0279774</sync-id> <structure-inchikey>CUDVFMRMTXRIGP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400010000000000000008000000008000000000000000000000020000000000000000010800000000000000000000020042040000000000000000000000000000000000000000000000000000000000000000010000001000800000000000000000000000000000020400000000040000000000000000002000000000400000000200000400000008080000000010000801400000001000000000000000000000000000400000000000000000800000040800001000000000800000000000000800000000000000000000000000000000000000000008910001002000040000000000000000020010000400000000000000000010000000000000000c0000000</structure-fingerprint> 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