65708 <common-name>5-(Benzylamino)pyrimidine-2,4(1h,3h)-dione</common-name> <description>5-(Benzylamino)pyrimidine-2,4(1h,3h)-dione belongs to the phenylmethylamines, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C11H11N3O2 and an average molecular weight of 217.23 g/mol.</description> <cas>28485-19-0</cas> <pubchem-id>273579</pubchem-id> <chemical-formula>C11H11N3O2</chemical-formula> <weight nil="true"/> <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">2026-04-03T05:03:41Z</created-at> <updated-at type="dateTime">2026-04-03T05:03:41Z</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>O=C1NC=C(NCC2=CC=CC=C2)C(=O)N1</moldb-smiles> <moldb-formula>C11H11N3O2</moldb-formula> <moldb-inchi>InChI=1S/C11H11N3O2/c15-10-9(7-13-11(16)14-10)12-6-8-4-2-1-3-5-8/h1-5,7,12H,6H2,(H2,13,14,15,16)</moldb-inchi> <moldb-inchikey>PBRBBWKUUQNONR-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">217.228</moldb-average-mass> <moldb-mono-mass type="decimal">217.085127</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>240718</chemspider-id> <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>CHEM061601</chemdb-id> <dsstox-id>DTXSID50297887</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00018262</susdat-id> <iupac>5-(benzylamino)-1H-pyrimidine-2,4-dione</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>Phenylmethylamines</subklass> <paper-count type="integer">11</paper-count> <sync-id>CED0034831</sync-id> <structure-inchikey>PBRBBWKUUQNONR-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>100000000000000800000840000000000000000000000000000000000010000000000000020000000000000000004000000000000000000000000000000000000000000000000000000000000020020000000000000000000000002000000000000020000000000000000000000000000000000000000000000000000000000000000200000800000200002000080000000000100000080000000000000000000000000000000000000080000000080000000000000000000000000000000000000000000000000000000000000000000000000000000004221000010000000000000000000000041000000000000000000000000400000080000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���(������@(������@8�������@h�������@(�������h��������`������@(������@h�������@h�������@h�������@h�������@h�������@(�������(������@8���������(���h���h���h��� ��������h�� h� h� �h���h�� h� �(� �h���h���h�B������� ����� �������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:16:37Z</structure-indexed-at> </compound>