N-[(4-methylphenyl)methyl]-2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepane-1-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepane-1-carboxamide
N-[(4-methylphenyl)methyl]-2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S545-0701 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]azepane-1-carboxamide |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C22 H25 N5 O2 |
| Smiles: | Cc1ccc(CNC(N2CCCCCC2c2nc(c3ccncc3)no2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1486 |
| logD: | 4.1485 |
| logSw: | -3.9791 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.889 |
| InChI Key: | RWVMMVPJCYCMGM-IBGZPJMESA-N |