2-(methylsulfanyl)-4-phenyl-N-{3-[(propan-2-yl)oxy]propyl}pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(methylsulfanyl)-4-phenyl-N-{3-[(propan-2-yl)oxy]propyl}pyrimidine-5-carboxamide
2-(methylsulfanyl)-4-phenyl-N-{3-[(propan-2-yl)oxy]propyl}pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0457 |
| Compound Name: | 2-(methylsulfanyl)-4-phenyl-N-{3-[(propan-2-yl)oxy]propyl}pyrimidine-5-carboxamide |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C18 H23 N3 O2 S |
| Smiles: | CC(C)OCCCNC(c1cnc(nc1c1ccccc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0285 |
| logD: | 3.0285 |
| logSw: | -3.3682 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.28 |
| InChI Key: | JDXHDZVJLKUYRZ-UHFFFAOYSA-N |