Basic information
- CAS
98533-90-5- Standard SMILES
CNC(=O)c1cnn(-c2ccc(F)cc2F)c1Cl- InChIKey
YFFJDCWRIKMANV-UHFFFAOYSA-N- Molecular formula
- C11H8ClF2N3O
- Average molar mass
- 271.65 g/mol
- Monoisotopic mass
- 271.0323959
Names & identifiers
- Preferred name
- 5-chloro-1-(2,4-difluorophenyl)-N-methylpyrazole-4-carboxamide
- IUPAC
- 5-chloro-1-(2,4-difluorophenyl)-N-methylpyrazole-4-carboxamide
Names & synonyms
5-chloro-1-(2,4-difluorophenyl)-N-methylpyrazole-4-carboxamide98533-90-5SCHEMBL10848149DTXSID102436635-chloro-1-(2,4-difluorophenyl)-N-methyl-1H-pyrazole-4-carboxamide
Database identifiers
- CAS
98533-90-5- PubChem CID
- 179073
- DTXSID
DTXSID10243663
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…