Basic information
- Standard SMILES
CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)c1ccccc1- InChIKey
JRYREIUNGAXWPG-KBPBESRZSA-N- Molecular formula
- C18H24N2O5
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.16852187
Names & identifiers
- Preferred name
- (S,S)-1-(2-tert-butoxycarbonylamino-2-phenyl-acetyl)-pyrrolidine-2-carboxylic acid
- IUPAC
- (2S)-1-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetyl]pyrrolidine-2-carboxylic acid
Names & synonyms
SCHEMBL1994336JRYREIUNGAXWPG-KBPBESRZSA-N(S,S)-1-(2-tert-butoxycarbonylamino-2-phenyl-acetyl)-pyrrolidine-2-carboxylic acid
Database identifiers
- PubChem CID
- 58310477
Properties
Computed structural properties
- XLogP
- 2.3
- 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
- 508
Related reactions
4 records
Compound notes
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