2-(4-methylphenoxy)-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenoxy)-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
2-(4-methylphenoxy)-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S545-0610 |
| Compound Name: | 2-(4-methylphenoxy)-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}ethan-1-one |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C22 H24 N4 O3 |
| Smiles: | Cc1ccc(cc1)OCC(N1CCCCCC1c1nc(c2cccnc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7866 |
| logD: | 3.1479 |
| logSw: | -3.5768 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.807 |
| InChI Key: | OEISADKTLVOFSS-IBGZPJMESA-N |