Basic information
- CAS
349614-44-4- Standard SMILES
Cc1cc(NS(=O)(=O)c2ccc(Br)cc2)no1- InChIKey
CIAPGWWOGQDTBG-UHFFFAOYSA-N- Molecular formula
- C10H9BrN2O3S
- Average molar mass
- 317.16 g/mol
- Monoisotopic mass
- 315.95173
Names & identifiers
- Preferred name
- 4-bromo-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
- IUPAC
- 4-bromo-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
Names & synonyms
349614-44-44-bromo-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamideDTXSID70349993RefChem:291063DTXCID403010634-Bromo-N-(5-methylisoxazol-3-yl)benzenesulfonamideBenzenesulfonamide, 4-bromo-N-(5-methyl-3-isoxazolyl)-[(4-bromophenyl)sulfonyl](5-methylisoxazol-3-yl)amine4-bromo-N-(5-methyl-1,2-oxazol-3-yl)benzene-1-sulfonamideCambridge id 6322832Oprea1_366149Oprea1_672165
Show more names
4-bromo-N-(5-methyl-3-isoxazolyl)BenzenesulfonamideSCHEMBL6667090CIAPGWWOGQDTBG-UHFFFAOYSA-NSTK069570AKOS003285391DA-39812ST044043CS-0280752
Database identifiers
- CAS
349614-44-4- PubChem CID
- 670321
- DTXSID
DTXSID70349993
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 349
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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