Structure Info
- Chemspace ID
- CSMB14904051296 (Enamine MADE)
- IUPAC Name
- 2-{bicyclo[1.1.1]pentane-1-sulfonyl}butanenitrile
- Mol formula
- C9H13NO2S
- Mol weight
- 199 Da
- Catalog Number(s)
- BBV-1073818090
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.89
- Heavy atoms count
- 13
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.888
- Polar surface area (Å)
- 58
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB14904051296
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