N-{4-[5-(4-methoxyphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{4-[5-(4-methoxyphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
N-{4-[5-(4-methoxyphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V005-7022 |
| Compound Name: | N-{4-[5-(4-methoxyphenyl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzamide |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C27 H28 N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2ccc(cc2)OC)n(c2ccc(cc2)NC(c2ccc(C)cc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.4342 |
| logD: | 6.434 |
| logSw: | -5.7648 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.824 |
| InChI Key: | UHVPXWPZSGFRPB-UHFFFAOYSA-N |