Basic information
- Standard SMILES
Cc1c(C(=O)Nc2ccc(Oc3ccnc(C(N)=O)c3)c(F)c2)c(=O)n(-c2ccccc2)n1C- InChIKey
AEUQVUHYNJZUMV-UHFFFAOYSA-N- Molecular formula
- C24H20FN5O4
- Average molar mass
- 461.4 g/mol
- Monoisotopic mass
- 461.1499323
Names & identifiers
- Preferred name
- 4-(4-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamido)-2-fluorophenoxy)picolinamide
- IUPAC
- 4-[4-[(1,5-dimethyl-3-oxo-2-phenylpyrazole-4-carbonyl)amino]-2-fluorophenoxy]pyridine-2-carboxamide
Names & synonyms
CHEMBL3703195SCHEMBL15560598AEUQVUHYNJZUMV-UHFFFAOYSA-NBDBM149702DB-099713US8975282, 101552281-01-24-(4-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carboxamido)-2-fluorophenoxy)picolinamide
Database identifiers
- PubChem CID
- 73053267
- ChEMBL
CHEMBL3703195
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 830
Related reactions
10 records
Compound notes
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