Basic information
- Standard SMILES
CC(C)S(=O)(=O)NCCc1ccc(Br)cc1- InChIKey
MXNMXXXEQDZQNV-UHFFFAOYSA-N- Molecular formula
- C11H16BrNO2S
- Average molar mass
- 306.22 g/mol
- Monoisotopic mass
- 305.00851
Names & identifiers
- Preferred name
- N-2-(4-bromophenyl)ethyl 2-propanesulfonamide
- IUPAC
- N-[2-(4-bromophenyl)ethyl]propane-2-sulfonamide
Names & synonyms
SCHEMBL5877603MXNMXXXEQDZQNV-UHFFFAOYSA-NN-2-(4-bromophenyl)ethyl 2-propanesulfonamide
Database identifiers
- PubChem CID
- 21893403
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 290
Related reactions
5 records
Compound notes
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