Basic information
- CAS
1132787-69-9- Standard SMILES
CC(C)C[C@H](NS(=O)(=O)c1cc(Br)ccc1Br)C(=O)O- InChIKey
APUZZAPFBWJBBN-JTQLQIEISA-N- Molecular formula
- C12H15Br2NO4S
- Average molar mass
- 429.13 g/mol
- Monoisotopic mass
- 426.90885
Names & identifiers
- Preferred name
- N-[(2,5-Dibromophenyl)sulfonyl]-L-leucine
- IUPAC
- (2S)-2-[(2,5-dibromophenyl)sulfonylamino]-4-methylpentanoic acid
Names & synonyms
DTXSID8012730501132787-69-9N-[(2,5-Dibromophenyl)sulfonyl]-L-leucineN-(2,5-Dibromobenzene-1-sulfonyl)-L-leucine
Database identifiers
- CAS
1132787-69-9- PubChem CID
- 28828958
- DTXSID
DTXSID801273050
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 435
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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