3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol
Chemical Structure Depiction of
3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol
3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol
Compound characteristics
| Compound ID: | 3253-2044 |
| Compound Name: | 3-{[(4H-1,2,4-triazol-4-yl)imino]methyl}phenol |
| Molecular Weight: | 188.19 |
| Molecular Formula: | C9 H8 N4 O |
| Smiles: | C(\c1cccc(c1)O)=N/n1cnnc1 |
| Stereo: | ACHIRAL |
| logP: | 0.2868 |
| logD: | 0.2834 |
| logSw: | -0.2114 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.823 |
| InChI Key: | VQKBHLPSAZGWEG-UHFFFAOYSA-N |