N-(2-methoxy-5-methylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
N-(2-methoxy-5-methylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1417 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide |
| Molecular Weight: | 331.43 |
| Molecular Formula: | C17 H21 N3 O2 S |
| Smiles: | CCCc1c(cnc(n1)SC)C(Nc1cc(C)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6105 |
| logD: | 3.5959 |
| logSw: | -3.6229 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.343 |
| InChI Key: | CGMPJGSDBJDFOF-UHFFFAOYSA-N |