Structure Info
- Chemspace ID
- CSMB20534212057 (Enamine MADE)
- IUPAC Name
- tert-butyl (1RS,6RS,8R)-8-amino-8-cyano-2-oxa-5-azabicyclo[4.2.0]octane-5-carboxylate
- Mol formula
- C12H19N3O3
- Mol weight
- 253 Da
- Catalog Number(s)
- BBV-1385815588
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.09
- Heavy atoms count
- 18
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 89
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20534212057
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