N-(4-bromo-2-methylphenyl)-2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
N-(4-bromo-2-methylphenyl)-2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M179-4196 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-2-{[6-(3,5-dimethylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 449.41 |
| Molecular Formula: | C20 H25 Br N4 O S |
| Smiles: | CC1CC(C)CN(C1)c1cc(ncn1)SCC(Nc1ccc(cc1C)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3567 |
| logD: | 5.3564 |
| logSw: | -5.3125 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.372 |
| InChI Key: | BXTRQDHPIMBSEU-UHFFFAOYSA-N |