Structure Info
- Chemspace ID
- CSMB00012870805 (Enamine MADE)
- MFCD
- MFCD24061968
- IUPAC Name
- 2-(2-aminoethanesulfonyl)butanenitrile
- Mol formula
- C6H12N2O2S
- Mol weight
- 176 Da
- Catalog Number(s)
- BBV-43913083, CSC012870805, FCH5868379
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -1.31
- Heavy atoms count
- 11
- Rotatable bond count
- 4
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 84
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00012870805
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