281742 <common-name>2-[(e)-1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine</common-name> <description>2-[(e)-1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine belongs to the pyrimidines and pyrimidine derivatives, a subclass of diazines within the organic compounds. This organoheterocyclic compound has the formula C11H16N6O3 and an average molecular weight of 280.28 g/mol.</description> <cas nil="true"/> <pubchem-id>9578656</pubchem-id> <chemical-formula>C11H16N6O3</chemical-formula> <weight>280.28</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">2026-08-27T17:07:28Z</created-at> <updated-at type="dateTime">2026-08-27T17:07:28Z</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(=NN=C(N)N)CC1(C(=O)NC(=O)NC1=O)CC=C</moldb-smiles> <moldb-formula>C11H16N6O3</moldb-formula> <moldb-inchi>InChI=1S/C11H16N6O3/c1-3-4-11(5-6(2)16-17-9(12)13)7(18)14-10(20)15-8(11)19/h3H,1,4-5H2,2H3,(H4,12,13,17)(H2,14,15,18,19,20)/b16-6+</moldb-inchi> <moldb-inchikey>LSTMILBQYSIMDR-OMCISZLKSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">280.1283884</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-1.5</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>CHEM277635</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>2-[(e)-1-(2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)propan-2-ylideneamino]guanidine</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>Diazines</klass> <subklass>Pyrimidines and pyrimidine derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0233700</sync-id> <structure-inchikey>LSTMILBQYSIMDR-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000800200000000000000000800000000000000000000020040000010000000000000000002000000000000000000000000000000000000000000000000004000020000000000200004004000000000000000000010000000000000000000000040000000008000000000000000000420000000048000000000000201000000000001000000000000000000000001000000000000000000000001200080000000000000000810080000000000000000000000000000000000000000000040000000000000000000000000000000000000000020200000080000000000000000000000000000002000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAUAAAAFAAAAIABBgBgAAAAAQMGACgAAAAD BAcAKAAAAAMDBwAoAAAAAwMGACgAAAADBAcAaAAAAAMBAgcAaAAAAAMBAgYA YAAAAAICBgAgAAAABAYAKAAAAAMECAAoAAAAAwIHAGgAAAADAgEGACgAAAAD BAgAKAAAAAMCBwBoAAAAAwIBBgAoAAAAAwQIACgAAAADAgYAYAAAAAICBgBo AAAAAwMBBgBoAAAAAwICCwABAAECKAICAyADBCgCBAUgBAYgAQcABwgACAkA CQooAgkLIAsMIAwNKAIMDiAODyAPECgCCBEAERIAEhMIAg8IAEIBAAAABggP DgwLCRcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:56:42Z</structure-indexed-at> </compound>