3-methyl-N-{3-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide
Chemical Structure Depiction of
3-methyl-N-{3-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide
3-methyl-N-{3-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide
Compound characteristics
| Compound ID: | V001-4993 |
| Compound Name: | 3-methyl-N-{3-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}butanamide |
| Molecular Weight: | 406.53 |
| Molecular Formula: | C24 H30 N4 O2 |
| Smiles: | CC(C)CC(Nc1cccc(c1)n1c(c2ccc(C)cc2)nc(n1)OCC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.481 |
| logD: | 6.481 |
| logSw: | -5.6311 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.339 |
| InChI Key: | QDFBSBVXJUXURN-UHFFFAOYSA-N |