Basic information
- CAS
73109-34-9- Standard SMILES
CSc1nc2c(Cl)ncnc2s1- InChIKey
DZHBTSNMJIBPJC-UHFFFAOYSA-N- Molecular formula
- C6H4ClN3S2
- Average molar mass
- 217.7 g/mol
- Monoisotopic mass
- 216.9535172
Names & identifiers
- Preferred name
- 7-Chloro-2-methylsulfanyl-[1,3]thiazolo[5,4-d]pyrimidine
- IUPAC
- 7-chloro-2-methylsulfanyl-[1,3]thiazolo[5,4-d]pyrimidine
Names & synonyms
73109-34-97-chloro-2-methylsulfanyl-[1,3]thiazolo[5,4-d]pyrimidineNSC365626SCHEMBL27250214SCHEMBL30897287DTXSID80320859NSC-3656267-Chloro-2-(methylsulfanyl)[1,3]thiazolo[5,4-d]pyrimidine
Database identifiers
- CAS
73109-34-9- PubChem CID
- 339352
- DTXSID
DTXSID80320859
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 171
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…