Basic information
- Standard SMILES
Cc1cc(OCc2ccccc2)nc(S(C)(=O)=O)n1- InChIKey
CSOZMXOXHFIFJC-UHFFFAOYSA-N- Molecular formula
- C13H14N2O3S
- Average molar mass
- 278.33 g/mol
Names & identifiers
- Preferred name
- 4-Benzyloxy-6-methyl-2-(methylsulfonyl)pyrimidine
- IUPAC
- 4-methyl-2-methylsulfonyl-6-phenylmethoxypyrimidine
Names & synonyms
SCHEMBL8558105CSOZMXOXHFIFJC-UHFFFAOYSA-N4-Benzyloxy-6-methyl-2-(methylsulfonyl)pyrimidine
Database identifiers
- PubChem CID
- 19690804
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 374
Related reactions
1 records
Compound notes
Loading…