1-{[1-(4-propylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
Chemical Structure Depiction of
1-{[1-(4-propylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
1-{[1-(4-propylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
Compound characteristics
| Compound ID: | F126-0297 |
| Compound Name: | 1-{[1-(4-propylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane |
| Molecular Weight: | 378.58 |
| Molecular Formula: | C21 H34 N2 O2 S |
| Smiles: | CCCc1ccc(cc1)S(N1CCC(CC1)CN1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9955 |
| logD: | 2.083 |
| logSw: | -4.5115 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.013 |
| InChI Key: | FCTUTGXDHKNNOU-UHFFFAOYSA-N |