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Basic information
- Standard SMILES
C[C@@H](c1ccc(Br)cc1)N1CCC2(CCC(=O)CC2)OC1=O- InChIKey
BVXQZGIOWDTFFV-LBPRGKRZSA-N- Molecular formula
- C17H20BrNO3
- Average molar mass
- 366.2 g/mol
Names & identifiers
- Preferred name
- 3-[(S)-1-(4-Bromo-phenyl)-ethyl]-1-oxa-3-aza-spiro[5.5]undecane-2,9-dione
- IUPAC
- 3-[(1S)-1-(4-bromophenyl)ethyl]-1-oxa-3-azaspiro[5.5]undecane-2,9-dione
Names & synonyms
SCHEMBL9985170CHEMBL3694623BVXQZGIOWDTFFV-LBPRGKRZSA-NBDBM125081US8765744, 11US8765744, 793-[(S)-1-(4-Bromo-phenyl)-ethyl]-1-oxa-3-aza-spiro[5.5]undecane-2,9-dione
Database identifiers
- PubChem CID
- 56595752
- ChEMBL
CHEMBL3694623
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 435
Related reactions
4 records
Compound notes
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