1-(4-{4-[(azepan-1-yl)methyl]piperidine-1-sulfonyl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[(azepan-1-yl)methyl]piperidine-1-sulfonyl}phenyl)ethan-1-one
1-(4-{4-[(azepan-1-yl)methyl]piperidine-1-sulfonyl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | M857-0058 |
| Compound Name: | 1-(4-{4-[(azepan-1-yl)methyl]piperidine-1-sulfonyl}phenyl)ethan-1-one |
| Molecular Weight: | 378.53 |
| Molecular Formula: | C20 H30 N2 O3 S |
| Smiles: | CC(c1ccc(cc1)S(N1CCC(CC1)CN1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1324 |
| logD: | 0.2198 |
| logSw: | -3.2005 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 49.84 |
| InChI Key: | ASBPXCMRDRUEGG-UHFFFAOYSA-N |