EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:228820 - 5-(4-benzylpiperazino)-2,4(1H,3H)-pyrimidinedione

ChEBI IDCHEBI:228820
ChEBI Name5-(4-benzylpiperazino)-2,4(1H,3H)-pyrimidinedione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H18N4O2
Net Charge0
Average Mass286.335
Monoisotopic Mass286.14298
SMILESO=c1ncc(N2CCN(Cc3ccccc3)CC2)c(=O)n1
InChIInChI=1S/C15H18N4O2/c20-14-13(10-16-15(21)17-14)19-8-6-18(7-9-19)11-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H2,16,17,20,21)
InChIKeyBQUYEGDTBNEKRQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
5-(4-benzylpiperazino)-2,4(1H,3H)-pyrimidinedione (CHEBI:228820) is a N-arylpiperazine (CHEBI:46848)
IUPAC Name 
5-(4-benzylpiperazin-1-yl)-1H-pyrimidine-2,4-dione
Manual XrefsDatabases
2093371ChemSpider