4-methyl-2-(methylsulfanyl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-methyl-2-(methylsulfanyl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide
4-methyl-2-(methylsulfanyl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0236 |
| Compound Name: | 4-methyl-2-(methylsulfanyl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 331.43 |
| Molecular Formula: | C17 H21 N3 O2 S |
| Smiles: | CC(C)Oc1ccc(CNC(c2cnc(nc2C)SC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2554 |
| logD: | 3.2554 |
| logSw: | -3.5173 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.846 |
| InChI Key: | GZWYOSUKPKBUBT-UHFFFAOYSA-N |