2-(6-benzyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-4-chlorophenol
Chemical Structure Depiction of
2-(6-benzyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-4-chlorophenol
2-(6-benzyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-4-chlorophenol
Compound characteristics
| Compound ID: | 8019-6318 |
| Compound Name: | 2-(6-benzyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-4-chlorophenol |
| Molecular Weight: | 386.84 |
| Molecular Formula: | C22 H15 Cl N4 O |
| Smiles: | C(c1ccccc1)c1c2ccccc2c2nnc(c3cc(ccc3O)[Cl])n2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3025 |
| logD: | 4.7393 |
| logSw: | -5.9346 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.214 |
| InChI Key: | IIERHRPDRDXGBU-UHFFFAOYSA-N |