phenyl{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
Chemical Structure Depiction of
phenyl{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
phenyl{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
Compound characteristics
| Compound ID: | S545-0659 |
| Compound Name: | phenyl{2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C20 H20 N4 O2 |
| Smiles: | C1CCC(c2nc(c3ccncc3)no2)N(CC1)C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.694 |
| logD: | 3.694 |
| logSw: | -3.7464 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.746 |
| InChI Key: | JOYKYLMGIVOBBQ-KRWDZBQOSA-N |