4-(4-Bromo-2-fluorophenylamino)-5-fluoro-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid

HCID 11617424

Basic information

Standard SMILES
Cn1cc(C(=O)O)c(Nc2ccc(Br)cc2F)c(F)c1=O
InChIKey
ZDECDUKQBAGZHQ-UHFFFAOYSA-N
Molecular formula
C13H9BrF2N2O3
Average molar mass
359.12 g/mol

Names & identifiers

Preferred name
4-(4-Bromo-2-fluorophenylamino)-5-fluoro-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid
IUPAC
4-(4-bromo-2-fluoroanilino)-5-fluoro-1-methyl-6-oxopyridine-3-carboxylic acid

Names & synonyms

CHEMBL2034174-(4-bromo-2-fluorophenylamino)-5-fluoro-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acidSCHEMBL388569ZDECDUKQBAGZHQ-UHFFFAOYSA-NBDBM50180563

Database identifiers

PubChem CID
11617424
ChEMBL
CHEMBL203417

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
69.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
21

Related reactions

20 records

Compound notes

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