2-{[2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide
2-{[2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | M181-1281 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 363.91 |
| Molecular Formula: | C18 H22 Cl N3 O S |
| Smiles: | CC(C)CCNC(CSc1cc(C)nc(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8881 |
| logD: | 4.8873 |
| logSw: | -4.8835 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.019 |
| InChI Key: | BGRIVPLRWMYWSZ-UHFFFAOYSA-N |