Basic information
- Standard SMILES
Cc1ccc(N)cc1Cn1ccc(NC(=O)c2c(F)cccc2F)n1- InChIKey
AXBUSXKXLHZDED-UHFFFAOYSA-N- Molecular formula
- C18H16F2N4O
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 342.12921747
Names & identifiers
- Preferred name
- N-{1-[(5-amino-2-methylphenyl)methyl]-1H-pyrazol-3-yl}-2,6-difluorobenzamide
- IUPAC
- N-[1-[(5-amino-2-methylphenyl)methyl]pyrazol-3-yl]-2,6-difluorobenzamide
Names & synonyms
SCHEMBL755866AXBUSXKXLHZDED-UHFFFAOYSA-NN-{1-[(5-amino-2-methylphenyl)methyl]-1H-pyrazol-3-yl}-2,6-difluorobenzamide
Database identifiers
- PubChem CID
- 59548012
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 456
Related reactions
4 records
Compound notes
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