Basic information
- CAS
80947-43-9- Standard SMILES
CC(=O)Nc1cc2cccnc2sc1=O- InChIKey
DZMVBQJTFJUTEF-UHFFFAOYSA-N- Molecular formula
- C10H8N2O2S
- Average molar mass
- 220.25 g/mol
- Monoisotopic mass
- 220.03064868
Names & identifiers
- Preferred name
- N-(2-oxothiopyrano[2,3-b]pyridin-3-yl)acetamide
- IUPAC
- N-(2-oxothiopyrano[2,3-b]pyridin-3-yl)acetamide
Names & synonyms
80947-43-9N-(2-oxo-2H-thiopyrano[2,3-b]pyridin-3-yl)acetamideN-(2-oxothiopyrano[2,3-b]pyridin-3-yl)acetamideNSC358745DTXSID60320372NSC-358745AE-411/41415594
Database identifiers
- CAS
80947-43-9- PubChem CID
- 338041
- DTXSID
DTXSID60320372
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 84.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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