N-(3,5-dimethylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
N-(3,5-dimethylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-1379 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-(methylsulfanyl)-4-propylpyrimidine-5-carboxamide |
| Molecular Weight: | 315.44 |
| Molecular Formula: | C17 H21 N3 O S |
| Smiles: | CCCc1c(cnc(n1)SC)C(Nc1cc(C)cc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2684 |
| logD: | 4.268 |
| logSw: | -4.2594 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.41 |
| InChI Key: | AJHHDTZZRANVKY-UHFFFAOYSA-N |