Basic information
- Standard SMILES
O=S(=O)(Nc1cc(Br)cnc1Cl)c1cccc(OC(F)F)c1- InChIKey
AKFKIFPYQPTHAT-UHFFFAOYSA-N- Molecular formula
- C12H8BrClF2N2O3S
- Average molar mass
- 413.62 g/mol
- Monoisotopic mass
- 411.90956
Names & identifiers
- Preferred name
- N-(5-bromo-2-chloropyridin-3-yl)-3-(difluoromethoxy)benzenesulfonamide
- IUPAC
- N-(5-bromo-2-chloro-3-pyridinyl)-3-(difluoromethoxy)benzenesulfonamide
Names & synonyms
N-(5-bromo-2-chloropyridin-3-yl)-3-(difluoromethoxy)benzenesulfonamideSCHEMBL1621783DB-1727231112983-26-2
Database identifiers
- PubChem CID
- 57749432
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 466
Related reactions
6 records
Compound notes
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