Basic information
- CAS
77408-60-7- Standard SMILES
CC(=O)Nc1ccc(S(=O)(=O)n2c(=O)oc3cc(Br)ccc32)cc1- InChIKey
VSSOSUMAJWXUHW-UHFFFAOYSA-N- Molecular formula
- C15H11BrN2O5S
- Average molar mass
- 411.2 g/mol
- Monoisotopic mass
- 409.95721
Names & identifiers
- Preferred name
- N-[4-(6-Bromo-2-oxo-1,3-benzoxazole-3(2H)-sulfonyl)phenyl]acetamide
- IUPAC
- N-[4-[(6-bromo-2-oxo-1,3-benzoxazol-3-yl)sulfonyl]phenyl]acetamide
Names & synonyms
77408-60-7NSC355388DTXSID80320152N-[4-(6-Bromo-2-oxo-1,3-benzoxazole-3(2H)-sulfonyl)phenyl]acetamideNSC-355388
Database identifiers
- CAS
77408-60-7- PubChem CID
- 337452
- DTXSID
DTXSID80320152
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
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