Basic information
- Standard SMILES
O=C(O)[C@H](CC1CCCCC1)Nc1nc2ccccc2o1- InChIKey
PUYIJKWQPDJUAU-ZDUSSCGKSA-N- Molecular formula
- C16H20N2O3
- Average molar mass
- 288.34 g/mol
Names & identifiers
- Preferred name
- 2-(S)-(benzooxazol-2-ylamino)-3-cyclohexyl propionic acid
- IUPAC
- (2S)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexylpropanoic acid
Names & synonyms
SCHEMBL5351968PUYIJKWQPDJUAU-ZDUSSCGKSA-N2-(S)-(benzooxazol-2-ylamino)-3-cyclohexyl propionic acid
Database identifiers
- PubChem CID
- 21082252
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 357
Related reactions
5 records
Compound notes
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