(3-methylphenyl){2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
Chemical Structure Depiction of
(3-methylphenyl){2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
(3-methylphenyl){2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone
Compound characteristics
| Compound ID: | S545-0735 |
| Compound Name: | (3-methylphenyl){2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepan-1-yl}methanone |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C21 H22 N4 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCCCCC1c1nc(c2ccncc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0861 |
| logD: | 4.086 |
| logSw: | -4.0951 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.746 |
| InChI Key: | QXTQOQMALTYKMV-SFHVURJKSA-N |