Basic information
- Standard SMILES
CC1(C)NC(=O)N(CC(=O)CSc2ccc(Br)cc2)C1=O- InChIKey
MHXVXNFOILEVLQ-UHFFFAOYSA-N- Molecular formula
- C14H15BrN2O3S
- Average molar mass
- 371.25 g/mol
- Monoisotopic mass
- 369.99868
Names & identifiers
- Preferred name
- 1-(4-Bromophenylthio)-3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-propanone
- IUPAC
- 3-[3-(4-bromophenyl)sulfanyl-2-oxopropyl]-5,5-dimethylimidazolidine-2,4-dione
Names & synonyms
SCHEMBL7443394MHXVXNFOILEVLQ-UHFFFAOYSA-N1-(4-bromophenylthio)-3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-propanone
Database identifiers
- PubChem CID
- 21700262
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 91.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 448
Related reactions
1 records
Compound notes
Loading…