N-(1-{[2-(benzylsulfanyl)-6-methylpyrimidin-4-yl]oxy}-2,2,2-trichloroethyl)-2,2-dimethylpropanamide
Chemical Structure Depiction of
N-(1-{[2-(benzylsulfanyl)-6-methylpyrimidin-4-yl]oxy}-2,2,2-trichloroethyl)-2,2-dimethylpropanamide
N-(1-{[2-(benzylsulfanyl)-6-methylpyrimidin-4-yl]oxy}-2,2,2-trichloroethyl)-2,2-dimethylpropanamide
Compound characteristics
| Compound ID: | 8009-1128 |
| Compound Name: | N-(1-{[2-(benzylsulfanyl)-6-methylpyrimidin-4-yl]oxy}-2,2,2-trichloroethyl)-2,2-dimethylpropanamide |
| Molecular Weight: | 462.82 |
| Molecular Formula: | C19 H22 Cl3 N3 O2 S |
| Smiles: | Cc1cc(nc(n1)SCc1ccccc1)OC(C([Cl])([Cl])[Cl])NC(C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2688 |
| logD: | 5.1914 |
| logSw: | -5.7472 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.845 |
| InChI Key: | KOTWXKUHMRFREO-INIZCTEOSA-N |