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CHEBI:107698 - [2-[(2-bromophenyl)methoxy]phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone

ChEBI IDCHEBI:107698
ChEBI Name[2-[(2-bromophenyl)methoxy]phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone
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DownloadsMolfile
FormulaC22H21BrN4O2
Net Charge0
Average Mass453.340
Monoisotopic Mass452.08479
SMILESO=C(c1ccccc1OCc1ccccc1Br)N1CCN(c2ncccn2)CC1
InChIInChI=1S/C22H21BrN4O2/c23-19-8-3-1-6-17(19)16-29-20-9-4-2-7-18(20)21(28)26-12-14-27(15-13-26)22-24-10-5-11-25-22/h1-11H,12-16H2
InChIKeyOBSNIISSPCGHGL-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
[2-[(2-bromophenyl)methoxy]phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone (CHEBI:107698) is a N-arylpiperazine (CHEBI:46848)
Manual XrefsDatabases
LSM-19077LINCS