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Structure Info
- Chemspace ID
- CSMB00037065371 (Enamine MADE)
- IUPAC Name
2-methyl-1,1-dioxo-1λ⁶-thiepane-2-carbonitrile
- Mol formula
- C8H13NO2S
- Mol weight
- 187 Da
- Catalog Number(s)
BBV-95058750, CSC037065371, FCH6219709
Properties
- LogP
- 0.78
- Heavy atoms count
- 12
- Rotatable bond count
- 0
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.875
- Polar surface area (Å)
- 58
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
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