Structure Info
- Chemspace ID
- CSMB00038137268 (Enamine MADE)
- IUPAC Name
- 1,1,5-trioxo-1λ⁶-thiomorpholine-2-carbonitrile
- Mol formula
- C5H6N2O3S
- Mol weight
- 174 Da
- Catalog Number(s)
- BBV-94972806, CSC038137268, FCH6078813
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -1.92
- Heavy atoms count
- 11
- Rotatable bond count
- 0
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.6
- Polar surface area (Å)
- 87
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00038137268
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