Basic information
- Standard SMILES
CC(C)[C@H](NC(=O)CBr)C(=O)NC(Cc1ccccc1)C(O)C(O)C(Cc1ccccc1)NC(=O)[C@@H](NC(=O)CBr)C(C)C- InChIKey
LOHIZSVJZLCSFD-FAPJWQGMSA-N- Molecular formula
- C32H44Br2N4O6
- Average molar mass
- 740.5 g/mol
- Monoisotopic mass
- 738.16276
Names & identifiers
- Preferred name
- 2,5-Di-{N-Bromoacetyl-(L)-Valyl}amino-3,4-dihydroxy-1,6-diphenyl hexane
- IUPAC
- (2S)-2-[(2-bromoacetyl)amino]-N-[5-[[(2S)-2-[(2-bromoacetyl)amino]-3-methylbutanoyl]amino]-3,4-dihydroxy-1,6-diphenylhexan-2-yl]-3-methylbutanamide
Names & synonyms
SCHEMBL7332623LOHIZSVJZLCSFD-FAPJWQGMSA-N2,5-Di-{N-Bromoacetyl-(L)-Valyl}amino-3,4-dihydroxy-1,6-diphenyl hexane
Database identifiers
- PubChem CID
- 70057716
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 157 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 17
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 839
Related reactions
6 records
Compound notes
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