Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc(Br)cc3)cs2)cc1- InChIKey
JMUKNDGBHXBZCS-UHFFFAOYSA-N- Molecular formula
- C16H13BrN2O2S2
- Average molar mass
- 409.3 g/mol
Names & identifiers
- Preferred name
- N-[4-(4-Bromo-phenyl)-thiazol-2-yl]-4-methyl-benzenesulfonamide
- IUPAC
- N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-methylbenzenesulfonamide
Names & synonyms
ZINC01513112SCHEMBL8355657JMUKNDGBHXBZCS-UHFFFAOYSA-NAKOS003850367N-[4-(4-Bromo-phenyl)-thiazol-2-yl]-4-methyl-benzenesulfonamide
Database identifiers
- PubChem CID
- 3547779
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 481
Related reactions
3 records
Compound notes
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