Basic information
- Standard SMILES
O=S(=O)(Nc1ncc(Cl)nc1OCc1cncc(Br)c1)c1cccc(Cl)c1Cl- InChIKey
BPKZMQDTAXKPRY-UHFFFAOYSA-N- Molecular formula
- C16H10BrCl3N4O3S
- Average molar mass
- 524.6 g/mol
- Monoisotopic mass
- 521.87226
Names & identifiers
- Preferred name
- N-{3-[(5-Bromo-3-pyridinyl)methoxy]-5-chloro-2-pyrazinyl}-2,3-dichlorobenzenesulphonamide
- IUPAC
- N-[3-[(5-bromo-3-pyridinyl)methoxy]-5-chloropyrazin-2-yl]-2,3-dichlorobenzenesulfonamide
Names & synonyms
SCHEMBL1733138BPKZMQDTAXKPRY-UHFFFAOYSA-NN-{3-[(5-Bromo-3-pyridinyl)methoxy]-5-chloro-2-pyrazinyl}-2,3-dichlorobenzenesulphonamide
Database identifiers
- PubChem CID
- 58597366
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 614
Related reactions
2 records
Compound notes
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