4-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzamide
4-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzamide
Compound characteristics
| Compound ID: | C301-9221 |
| Compound Name: | 4-bromo-N-[1,5-dimethyl-3-(4H-1,2,4-triazol-4-yl)-1H-pyrazol-4-yl]benzamide |
| Molecular Weight: | 361.2 |
| Molecular Formula: | C14 H13 Br N6 O |
| Smiles: | Cc1c(c(nn1C)n1cnnc1)NC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0585 |
| logD: | -1.4013 |
| logSw: | -2.0718 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.161 |
| InChI Key: | IDQRGJZCLAUVNA-UHFFFAOYSA-N |