N-{4-[(5-Bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)sulfonyl]phenyl}acetamide
Basic information
- CAS
77408-58-3- Standard SMILES
CC(=O)Nc1ccc(S(=O)(=O)n2c(=O)oc3ccc(Br)cc32)cc1- InChIKey
JKOPJASRJMXNBR-UHFFFAOYSA-N- Molecular formula
- C15H11BrN2O5S
- Average molar mass
- 411.2 g/mol
- Monoisotopic mass
- 409.95721
Names & identifiers
- Preferred name
- N-{4-[(5-Bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)sulfonyl]phenyl}acetamide
- IUPAC
- N-[4-[(5-bromo-2-oxo-1,3-benzoxazol-3-yl)sulfonyl]phenyl]acetamide
Names & synonyms
77408-58-3NSC355386N-{4-[(5-Bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)sulfonyl]phenyl}acetamideDTXSID60320150NSC-355386N-[4-(5-Bromo-2-oxo-1,3-benzoxazole-3(2H)-sulfonyl)phenyl]acetamide
Database identifiers
- CAS
77408-58-3- PubChem CID
- 337450
- DTXSID
DTXSID60320150
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 612
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…