2-chloro-N-(6-chloro-2-methylsulfanylpyrimidin-4-yl)acetamide
Basic information
- CAS
89793-61-3- Standard SMILES
CSc1nc(Cl)cc(NC(=O)CCl)n1- InChIKey
QJTUYVURMXVFMO-UHFFFAOYSA-N- Molecular formula
- C7H7Cl2N3OS
- Average molar mass
- 252.12 g/mol
- Monoisotopic mass
- 250.9686884
Names & identifiers
- Preferred name
- 2-chloro-N-(6-chloro-2-methylsulfanylpyrimidin-4-yl)acetamide
- IUPAC
- 2-chloro-N-(6-chloro-2-methylsulfanylpyrimidin-4-yl)acetamide
Names & synonyms
89793-61-3NSC79224DTXSID601008978NSC-79224DS-0131502-chloro-N-(6-chloro-2-methylsulfanyl-pyrimidin-4-yl)acetamide2-Chloro-N-[6-chloro-2-(methylsulfanyl)pyrimidin-4(3H)-ylidene]acetamide
Database identifiers
- CAS
89793-61-3- PubChem CID
- 254698
- DTXSID
DTXSID601008978
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 80.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 207
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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