2-phenoxy-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-phenoxy-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
2-phenoxy-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S545-0638 |
| Compound Name: | 2-phenoxy-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | C1CCC(c2nc(c3cccnc3)no2)N(CC1)C(COc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3347 |
| logD: | 2.696 |
| logSw: | -3.2299 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.807 |
| InChI Key: | PJCUSPUNCBTTOO-SFHVURJKSA-N |