2-(4-methylphenyl)-1-{4-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenyl)-1-{4-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
2-(4-methylphenyl)-1-{4-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S454-0504 |
| Compound Name: | 2-(4-methylphenyl)-1-{4-[4-(3-propyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 394.48 |
| Molecular Formula: | C21 H26 N6 O2 |
| Smiles: | CCCc1nc(c2cn(C3CCN(CC3)C(Cc3ccc(C)cc3)=O)nn2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.3738 |
| logD: | 3.3738 |
| logSw: | -3.1858 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 75.033 |
| InChI Key: | XBLWLZMALQRSPJ-UHFFFAOYSA-N |