Basic information
- Standard SMILES
Cn1cc(Br)c(-c2c(F)ccc(NS(=O)(=O)c3cc(F)ccc3F)c2F)n1- InChIKey
TXPBWMVSGCJZGL-UHFFFAOYSA-N- Molecular formula
- C16H10BrF4N3O2S
- Average molar mass
- 464.2 g/mol
Names & identifiers
- Preferred name
- N-[3-(4-bromo-1-methyl-1H-pyrazol-3-yl)-2,4-difluoro-phenyl]-2,5-difluorobenzenesulfonamide
- IUPAC
- N-[3-(4-bromo-1-methylpyrazol-3-yl)-2,4-difluorophenyl]-2,5-difluorobenzenesulfonamide
Names & synonyms
SCHEMBL1845402TXPBWMVSGCJZGL-UHFFFAOYSA-NN-[3-(4-bromo-1-methyl-1H-pyrazol-3-yl)-2,4-difluoro-phenyl]-2,5-difluorobenzenesulfonamide
Database identifiers
- PubChem CID
- 67183603
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 72.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 625
Related reactions
3 records
Compound notes
Loading…