Basic information
- CAS
64600-57-3- Standard SMILES
CSc1nc2n(C)cc(C)cc-2c(=O)n1- InChIKey
VRLHUAZZFAJBHK-UHFFFAOYSA-N- Molecular formula
- C10H11N3OS
- Average molar mass
- 221.28 g/mol
- Monoisotopic mass
- 221.06228316
Names & identifiers
- Preferred name
- 6,8-Dimethyl-2-(methylsulfanyl)pyrido[2,3-d]pyrimidin-4(8H)-one
- IUPAC
- 6,8-dimethyl-2-methylsulfanylpyrido[2,3-d]pyrimidin-4-one
Names & synonyms
64600-57-3NSC269230DTXSID103133556,8-Dimethyl-2-(methylsulfanyl)pyrido[2,3-d]pyrimidin-4(8H)-oneNSC-269230
Database identifiers
- CAS
64600-57-3- PubChem CID
- 320730
- DTXSID
DTXSID10313355
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 70.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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