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CHEBI:131163 - RGFP966

Default Structure
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.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
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
(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
RGFP 966ChEBI
RGFP-966ChEBI
Registry NumbersSources
CAS:1396841-57-8ChEBI
Citations