1-{[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
Chemical Structure Depiction of
1-{[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
1-{[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
Compound characteristics
| Compound ID: | M857-0061 |
| Compound Name: | 1-{[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane |
| Molecular Weight: | 364.55 |
| Molecular Formula: | C20 H32 N2 O2 S |
| Smiles: | Cc1cc(C)cc(c1)S(N1CCC(CC1)CN1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3295 |
| logD: | 1.417 |
| logSw: | -4.1442 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.013 |
| InChI Key: | LCFSYIXBUPOXII-UHFFFAOYSA-N |