2-(4-fluorophenoxy)-1-{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenoxy)-1-{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
2-(4-fluorophenoxy)-1-{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S545-0727 |
| Compound Name: | 2-(4-fluorophenoxy)-1-{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one |
| Molecular Weight: | 396.42 |
| Molecular Formula: | C21 H21 F N4 O3 |
| Smiles: | C1CCC(c2nc(c3ccncc3)no2)N(CC1)C(COc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6238 |
| logD: | 3.6238 |
| logSw: | -3.5302 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.717 |
| InChI Key: | LJHQGLSJDFWXKA-SFHVURJKSA-N |