4-bromo-2-{[(4H-1,2,4-triazol-4-yl)amino]methyl}phenol
Chemical Structure Depiction of
4-bromo-2-{[(4H-1,2,4-triazol-4-yl)amino]methyl}phenol
4-bromo-2-{[(4H-1,2,4-triazol-4-yl)amino]methyl}phenol
Compound characteristics
| Compound ID: | 8017-8273 |
| Compound Name: | 4-bromo-2-{[(4H-1,2,4-triazol-4-yl)amino]methyl}phenol |
| Molecular Weight: | 269.1 |
| Molecular Formula: | C9 H9 Br N4 O |
| Smiles: | C(c1cc(ccc1O)[Br])Nn1cnnc1 |
| Stereo: | ACHIRAL |
| logP: | 0.996 |
| logD: | 0.9954 |
| logSw: | -1.1942 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.865 |
| InChI Key: | TVJLPFJHWBJWBX-UHFFFAOYSA-N |