3-(4-{[1-(benzenesulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(4-{[1-(benzenesulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one
3-(4-{[1-(benzenesulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S787-1478 |
| Compound Name: | 3-(4-{[1-(benzenesulfonyl)piperidin-4-yl]methyl}phenyl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 440.6 |
| Molecular Formula: | C25 H32 N2 O3 S |
| Smiles: | C1CCN(C1)C(CCc1ccc(CC2CCN(CC2)S(c2ccccc2)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4978 |
| logD: | 4.4978 |
| logSw: | -4.3658 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.165 |
| InChI Key: | AILHFEHLYCPAFI-UHFFFAOYSA-N |