(2,5-dimethylphenyl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone
Chemical Structure Depiction of
(2,5-dimethylphenyl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone
(2,5-dimethylphenyl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | S457-0659 |
| Compound Name: | (2,5-dimethylphenyl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone |
| Molecular Weight: | 394.48 |
| Molecular Formula: | C21 H26 N6 O2 |
| Smiles: | CC(C)c1nc(c2cn(C3CCCN(C3)C(c3cc(C)ccc3C)=O)nn2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3624 |
| logD: | 3.3624 |
| logSw: | -3.2084 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.504 |
| InChI Key: | HTLHHQBGBSEPNQ-INIZCTEOSA-N |