Basic information
- Standard SMILES
N[C@H]1C[C@@H](c2nc3ccccc3o2)N(C(=O)OCc2ccccc2)C1- InChIKey
BOVJWRKSKBWQOQ-HOCLYGCPSA-N- Molecular formula
- C19H19N3O3
- Average molar mass
- 337.4 g/mol
Names & identifiers
- Preferred name
- (2S,4S)-4-amino-2-benzooxazol-2-yl-pyrrolidine-1-carboxylic acid benzyl ester
- IUPAC
- benzyl (2S,4S)-4-amino-2-(1,3-benzoxazol-2-yl)pyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL15211849BOVJWRKSKBWQOQ-HOCLYGCPSA-N(2S,4S)-4-amino-2-benzooxazol-2-yl-pyrrolidine-1-carboxylic acid benzyl ester
Database identifiers
- PubChem CID
- 89768299
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 81.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 469
Related reactions
4 records
Compound notes
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