Structure Info
- Chemspace ID
- CSMB00102716643 (Enamine MADE)
- CAS
- 2137808-28-5
- MFCD
- MFCD31448009
- IUPAC Name
- methyl 4-[(aminosulfinyl)methyl]oxane-4-carboxylate
- Mol formula
- C8H15NO4S
- Mol weight
- 221 Da
- Catalog Number(s)
- BBV-113303752, CSC102716643, EN300-732675, FCH13452224
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.75
- Heavy atoms count
- 14
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.875
- Polar surface area (Å)
- 79
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00102716643
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