Structure Info
- Chemspace ID
- CSMB06529756079 (Enamine MADE)
- CAS
- 2694057-93-5
- MFCD
- MFCD34475387
- IUPAC Name
- 4-[(1S,4S)-5-[(tert-butoxy)carbonyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-fluorobenzoic acid
- Mol formula
- C17H21FN2O4
- Mol weight
- 336 Da
- Catalog Number(s)
- EN300-6733635
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.64
- Heavy atoms count
- 24
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.529
- Polar surface area (Å)
- 70
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB06529756079
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