2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide
2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | M459-3933 |
| Compound Name: | 2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-chlorophenyl)acetamide |
| Molecular Weight: | 453.01 |
| Molecular Formula: | C24 H25 Cl N4 O S |
| Smiles: | C1CN(CCC1Cc1ccccc1)c1ccnc(n1)SCC(Nc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.5436 |
| logD: | 6.5435 |
| logSw: | -6.4056 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.486 |
| InChI Key: | FFQNVGFWUMLYSD-UHFFFAOYSA-N |