N-(2,5-dimethylphenyl)-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-(2,5-dimethylphenyl)-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1047 |
| Compound Name: | N-(2,5-dimethylphenyl)-4-ethyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 301.41 |
| Molecular Formula: | C16 H19 N3 O S |
| Smiles: | CCc1c(cnc(n1)SC)C(Nc1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.291 |
| logD: | 3.29 |
| logSw: | -3.3915 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.712 |
| InChI Key: | MTXADTWSSVCJOU-UHFFFAOYSA-N |