3-methyl-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}butan-1-one
Chemical Structure Depiction of
3-methyl-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}butan-1-one
3-methyl-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S545-0590 |
| Compound Name: | 3-methyl-1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}butan-1-one |
| Molecular Weight: | 328.41 |
| Molecular Formula: | C18 H24 N4 O2 |
| Smiles: | CC(C)CC(N1CCCCCC1c1nc(c2cccnc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3954 |
| logD: | 2.7567 |
| logSw: | -3.3422 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.579 |
| InChI Key: | BDJHWIOCKHZSGC-HNNXBMFYSA-N |