Basic information
- Standard SMILES
CCOC(=O)c1nc(Br)ccc1N(C)S(C)(=O)=O- InChIKey
AQRUERRZWROEEJ-UHFFFAOYSA-N- Molecular formula
- C10H13BrN2O4S
- Average molar mass
- 337.19 g/mol
Names & identifiers
- Preferred name
- Ethyl 6-bromo-3-[methyl(methylsulfonyl)amino]pyridine-2-carboxylate
- IUPAC
- ethyl 6-bromo-3-[methyl(methylsulfonyl)amino]pyridine-2-carboxylate
Names & synonyms
SCHEMBL15574218AQRUERRZWROEEJ-UHFFFAOYSA-Nethyl 6-bromo-3-[methyl(methylsulfonyl)amino]pyridine-2-carboxylate
Database identifiers
- PubChem CID
- 90044112
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 395
Related reactions
1 records
Compound notes
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