Basic information
- Standard SMILES
COc1ccc(C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)O)C(C)C)cc1- InChIKey
MJIQXRBDQZYHCC-GJZGRUSLSA-N- Molecular formula
- C18H24N2O5
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.16852187
Names & identifiers
- Preferred name
- N-(4-methoxybenzoyl)-L-valyl-L-proline
- IUPAC
- (2S)-1-[(2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carboxylic acid
Names & synonyms
SCHEMBL7362814MJIQXRBDQZYHCC-GJZGRUSLSA-NN-(4-methoxybenzoyl)-L-valyl-L-proline
Database identifiers
- PubChem CID
- 10736489
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 95.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 500
Related reactions
6 records
Compound notes
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