283577 <common-name>5-(2-bromoprop-2-enyl)-5-cyclopent-2-en-1-yl-1,3-diazinane-2,4,6-trione</common-name> <description>5-(2-bromoprop-2-enyl)-5-cyclopent-2-en-1-yl-1,3-diazinane-2,4,6-trione belongs to the pyrimidines and pyrimidine derivatives, a subclass of diazines within the organic compounds. It is categorized as an organoheterocyclic compound with the chemical formula C12H13BrN2O3 and an average molecular weight of 313.15 g/mol.</description> <cas>66942-08-3</cas> <pubchem-id>48593</pubchem-id> <chemical-formula>C12H13BrN2O3</chemical-formula> <weight>313.15</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">2026-08-27T19:08:43Z</created-at> <updated-at type="dateTime">2026-08-27T19:08:43Z</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>C=C(CC1(C(=O)NC(=O)NC1=O)C2CCC=C2)Br</moldb-smiles> <moldb-formula>C12H13BrN2O3</moldb-formula> <moldb-inchi>InChI=1S/C12H13BrN2O3/c1-7(13)6-12(8-4-2-3-5-8)9(16)14-11(18)15-10(12)17/h2,4,8H,1,3,5-6H2,(H2,14,15,16,17,18)</moldb-inchi> <moldb-inchikey>RHOHXKFFYZVGKS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">312.01095</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.8</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>CHEM279470</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>5-(2-bromoprop-2-enyl)-5-cyclopent-2-en-1-yl-1,3-diazinane-2,4,6-trione</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>CED0235485</sync-id> <structure-inchikey>RHOHXKFFYZVGKS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000000000800000000000000000000000000000000000000000008000000000000020008000000000040000000000000000000000000200000000000000000000000010000000000000000020000000000000004000800000000400000000010000000000000000000000040000020000000000000000000000120000000008000010000000220080001000000000000000000000000000001000000000020004000000000200080000000000000000000080000000000000000000040000000000000000000000000800000000000000000000000000000000000000000000002000000040000000000000000000000002000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>500440001102860480000260110820000000150003052040003420408220004c4c020050108000040100410800c0000004200024808c32010200f43100b04000c51104001210040000901000006202000800058051011a3240040462400208040c3800070048020a70040000d4b40000208680100101c0043118026002110002004100184cd8020808060240082c0018191c0812444014022000088000c00086004320000018c00002000948056c651002c00002894108401802421008400210800100a404900012018000041411028004010000020050200d00020408000100b0100c10000000000000040551362000001000308042000e0100108072010086</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���h��������(�������`������� ������(�������(�������h��������(�������(�������h��������(�������(�������`�������`�������`�������h��������h������#� ��������������������(��� �� ��(�� �(����� � ������������ �����B�������� �� ��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:58:06Z</structure-indexed-at> </compound>