3-methyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)butanamide
Chemical Structure Depiction of
3-methyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)butanamide
3-methyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)butanamide
Compound characteristics
| Compound ID: | G717-1950 |
| Compound Name: | 3-methyl-N-(2-{5-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)butanamide |
| Molecular Weight: | 300.4 |
| Molecular Formula: | C17 H24 N4 O |
| Smiles: | CC(C)CC(NCCc1nc(Cc2ccc(C)cc2)[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7206 |
| logD: | 2.7191 |
| logSw: | -3.0617 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.317 |
| InChI Key: | JDQRWVCIDZIMDC-UHFFFAOYSA-N |