5-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-2-methoxybenzamide
Chemical Structure Depiction of
5-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-2-methoxybenzamide
5-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | C301-9210 |
| Compound Name: | 5-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]-2-methoxybenzamide |
| Molecular Weight: | 391.22 |
| Molecular Formula: | C15 H15 Br N6 O2 |
| Smiles: | Cc1c(c(nn1C)n1cnnc1)NC(c1cc(ccc1OC)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0847 |
| logD: | -2.6151 |
| logSw: | -2.3897 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.792 |
| InChI Key: | OTVHPLPTLIGUKI-UHFFFAOYSA-N |