Basic information
- CAS
874899-07-7- Standard SMILES
CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)Nc1ccccc1.Cl- InChIKey
DQECNHXUZROJHU-YYLIZZNMSA-N- Molecular formula
- C17H28ClN3O2
- Average molar mass
- 341.9 g/mol
- Monoisotopic mass
- 341.1870048
Names & identifiers
- Preferred name
- (2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-methyl-N-phenylpentanamide;hydrochloride
- IUPAC
- (2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-methyl-N-phenylpentanamide;hydrochloride
Database identifiers
- CAS
874899-07-7- PubChem CID
- 11624293
Properties
Computed structural properties
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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