N-(4-bromo-3-methylphenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
N-(4-bromo-3-methylphenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M179-0104 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-{[6-(pyrrolidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 407.33 |
| Molecular Formula: | C17 H19 Br N4 O S |
| Smiles: | Cc1cc(ccc1[Br])NC(CSc1cc(ncn1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5776 |
| logD: | 4.5775 |
| logSw: | -4.3093 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.569 |
| InChI Key: | CBDVGLOFZBTAOU-UHFFFAOYSA-N |