4-bromo-2-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol
Chemical Structure Depiction of
4-bromo-2-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol
4-bromo-2-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol
Compound characteristics
| Compound ID: | 2222-0348 |
| Compound Name: | 4-bromo-2-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol |
| Molecular Weight: | 267.08 |
| Molecular Formula: | C9 H7 Br N4 O |
| Smiles: | C(\c1cc(ccc1O)[Br])=N/n1cnnc1 |
| Stereo: | ACHIRAL |
| logP: | 1.4302 |
| logD: | 1.3015 |
| logSw: | -1.0078 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.754 |
| InChI Key: | ZNJKBUYYFGCGNR-UHFFFAOYSA-N |