2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
Compound characteristics
| Compound ID: | M459-5413 |
| Compound Name: | 2-{[4-(4-benzylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl}-N-(3-phenylpropyl)acetamide |
| Molecular Weight: | 460.64 |
| Molecular Formula: | C27 H32 N4 O S |
| Smiles: | C(Cc1ccccc1)CNC(CSc1nccc(n1)N1CCC(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2226 |
| logD: | 6.2225 |
| logSw: | -5.8581 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.65 |
| InChI Key: | HOFLEEHCHGYXOA-UHFFFAOYSA-N |