N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}heptanamide
Chemical Structure Depiction of
N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}heptanamide
N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}heptanamide
Compound characteristics
| Compound ID: | V007-9112 |
| Compound Name: | N-{4-[5-(4-methylphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}heptanamide |
| Molecular Weight: | 434.58 |
| Molecular Formula: | C26 H34 N4 O2 |
| Salt: | not_available |
| Smiles: | CCCCCCC(Nc1ccc(cc1)n1c(c2ccc(C)cc2)nc(n1)OCC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1907 |
| logD: | 7.1907 |
| logSw: | -5.6154 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.339 |
| InChI Key: | AHBRGAVFTDHQPC-UHFFFAOYSA-N |