1-[4-(benzenesulfonyl)-2-(2-bromophenyl)-1,3-oxazol-5-yl]azepane
Chemical Structure Depiction of
1-[4-(benzenesulfonyl)-2-(2-bromophenyl)-1,3-oxazol-5-yl]azepane
1-[4-(benzenesulfonyl)-2-(2-bromophenyl)-1,3-oxazol-5-yl]azepane
Compound characteristics
| Compound ID: | 6285-0254 |
| Compound Name: | 1-[4-(benzenesulfonyl)-2-(2-bromophenyl)-1,3-oxazol-5-yl]azepane |
| Molecular Weight: | 461.38 |
| Molecular Formula: | C21 H21 Br N2 O3 S |
| Smiles: | C1CCCN(CC1)c1c(nc(c2ccccc2[Br])o1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2074 |
| logD: | 5.2074 |
| logSw: | -5.3269 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.81 |
| InChI Key: | BUEFIRHJNAKXIK-UHFFFAOYSA-N |