1-{[1-(3-chloro-4-fluorobenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
Chemical Structure Depiction of
1-{[1-(3-chloro-4-fluorobenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
1-{[1-(3-chloro-4-fluorobenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane
Compound characteristics
| Compound ID: | F126-0344 |
| Compound Name: | 1-{[1-(3-chloro-4-fluorobenzene-1-sulfonyl)piperidin-4-yl]methyl}azepane |
| Molecular Weight: | 388.93 |
| Molecular Formula: | C18 H26 Cl F N2 O2 S |
| Smiles: | C1CCCN(CC1)CC1CCN(CC1)S(c1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0863 |
| logD: | 1.1737 |
| logSw: | -4.3833 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.013 |
| InChI Key: | YXBFEEWBIZELLT-UHFFFAOYSA-N |