Basic information
- Standard SMILES
CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Br)cn2)cc1- InChIKey
HAURPVJEEAFBSY-UHFFFAOYSA-N- Molecular formula
- C13H11BrN2O3S
- Average molar mass
- 355.21 g/mol
Names & identifiers
- Preferred name
- N-(5-Bromopyridin-2-yl)-4-methanesulfonylbenzamide
- IUPAC
- N-(5-bromo-2-pyridinyl)-4-methylsulfonylbenzamide
Names & synonyms
N-(5-Bromopyridin-2-yl)-4-methanesulfonylbenzamideSCHEMBL1576873HAURPVJEEAFBSY-UHFFFAOYSA-NAKOS008968542
Database identifiers
- PubChem CID
- 60650971
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 441
Related reactions
3 records
Compound notes
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