CHEBI:105578 - 3-(5-methyl-2-furanyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one

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ChEBI Name 3-(5-methyl-2-furanyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one
ChEBI ID CHEBI:105578
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H18N4O2
Net Charge 0
Average Mass 298.340
Monoisotopic Mass 298.14298
InChI InChI=1S/C16H18N4O2/c1-13-3-4-14(22-13)5-6-15(21)19-9-11-20(12-10-19)16-17-7-2-8-18-16/h2-8H,9-12H2,1H3
InChIKey ZQASEDXTLUSBAI-UHFFFAOYSA-N
SMILES CC1=CC=C(O1)C=CC(=O)N2CCN(CC2)C3=NC=CC=N3
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 3-(5-methyl-2-furanyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one (CHEBI:105578) is a N-arylpiperazine (CHEBI:46848)
Manual Xref Database
LSM-16941 LINCS
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