2-(methylsulfanyl)-4-phenyl-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(methylsulfanyl)-4-phenyl-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide
2-(methylsulfanyl)-4-phenyl-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0563 |
| Compound Name: | 2-(methylsulfanyl)-4-phenyl-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C22 H23 N3 O2 S |
| Smiles: | CC(C)Oc1ccc(CNC(c2cnc(nc2c2ccccc2)SC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5288 |
| logD: | 4.5288 |
| logSw: | -4.2197 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.768 |
| InChI Key: | HFXNFKJTAJLQOI-UHFFFAOYSA-N |