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CHEBI:131163 - RGFP966

ChEBI IDCHEBI:131163
ChEBI NameRGFP966
Stars
DefinitionA member of the class of pyrazoles that is 1H-pyrazole substituted by (1E)-1-phenylprop-1-en-3-yl and (1E)-3-(2-amino-4-fluoroanilino)-3-oxoprop-1-en-1-yl groups at positions 1 and 4, respectively. It is a histone deacetylase 3 inhibitor.
Last Modified21 June 2024
DownloadsMolfile
FormulaC21H19FN4O
Net Charge0
Average Mass362.408
Monoisotopic Mass362.15429
SMILESNc1cc(F)ccc1NC(=O)/C=C/c1cnn(C/C=C/c2ccccc2)c1
InChIInChI=1S/C21H19FN4O/c22-18-9-10-20(19(23)13-18)25-21(27)11-8-17-14-24-26(15-17)12-4-7-16-5-2-1-3-6-16/h1-11,13-15H,12,23H2,(H,25,27)/b7-4+,11-8+
InChIKeyBLVQHYHDYFTPDV-VCABWLAWSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
EC 3.5.1.98 (histone deacetylase) inhibitor  An EC 3.5.1.* (non-peptide linear amide C-N hydrolase) inhibitor that interferes with the function of histone deacetylase (EC 3.5.1.98).
Applications:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
RGFP966 (CHEBI:131163) has role anti-inflammatory agent (CHEBI:67079)
RGFP966 (CHEBI:131163) has role antidepressant (CHEBI:35469)
RGFP966 (CHEBI:131163) has role EC 3.5.1.98 (histone deacetylase) inhibitor (CHEBI:61115)
RGFP966 (CHEBI:131163) has role neuroprotective agent (CHEBI:63726)
RGFP966 (CHEBI:131163) is a aromatic amide (CHEBI:62733)
RGFP966 (CHEBI:131163) is a enamide (CHEBI:51751)
RGFP966 (CHEBI:131163) is a monofluorobenzenes (CHEBI:83575)
RGFP966 (CHEBI:131163) is a pyrazoles (CHEBI:26410)
RGFP966 (CHEBI:131163) is a substituted aniline (CHEBI:48975)
IUPAC Name 
(2E)-N-(2-amino-4-fluorophenyl)-3-{1-[(2E)-3-phenylprop-2-en-1-yl]-1H-pyrazol-4-yl}prop-2-enamide
Synonyms  Source
RGFP-966ChEBI
RGFP 966ChEBI
(2E)-N-(2-amino-4-fluorophenyl)-3-[(2E)-1-(3-phenyl-2-propen-1-yl)-1H-pyrazol-4-yl]-2-propenamideChEBI
(E)-N-(2-amino-4-fluorophenyl)-3-(1-cinnamyl-1H-pyrazol-4-yl)acrylamideChEBI
Registry NumbersSources
CAS:1396841-57-8ChEBI
Citations