Basic information
- Standard SMILES
CCC(C(=O)OC(C)(C)C)[C@](N)(O)c1nnc(-c2cccnc2)o1- InChIKey
NFBPBPDNDKIXSP-NBFOKTCDSA-N- Molecular formula
- C16H22N4O4
- Average molar mass
- 334.37 g/mol
Names & identifiers
- Preferred name
- (S)-2-Boc-amino-1-(5-pyridin-3-yl-[1,3,4]oxadiazol-2-yl)-butan-1-ol
- IUPAC
- tert-butyl 2-[(S)-amino-hydroxy-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]butanoate
Names & synonyms
SCHEMBL5945966NFBPBPDNDKIXSP-NBFOKTCDSA-N(S)-2-Boc-amino-1-(5-pyridin-3-yl-[1,3,4]oxadiazol-2-yl)-butan-1-ol
Database identifiers
- PubChem CID
- 69616467
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 442
Related reactions
1 records
Compound notes
Loading…