3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-{[4-(propan-2-yl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-{[4-(propan-2-yl)phenyl]methyl}propanamide
3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-{[4-(propan-2-yl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | M306-0695 |
| Compound Name: | 3-[1-(2-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-{[4-(propan-2-yl)phenyl]methyl}propanamide |
| Molecular Weight: | 442.62 |
| Molecular Formula: | C25 H34 N2 O3 S |
| Smiles: | CC(C)c1ccc(CNC(CCC2CCN(CC2)S(c2ccccc2C)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0138 |
| logD: | 5.0138 |
| logSw: | -4.5387 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.149 |
| InChI Key: | XHRPQZHFSQKUTK-UHFFFAOYSA-N |