4,5-diphenyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4,5-diphenyl-4H-1,2,4-triazole-3-thiol
4,5-diphenyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 2219-0001 |
| Compound Name: | 4,5-diphenyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 253.32 |
| Molecular Formula: | C14 H11 N3 S |
| Smiles: | c1ccc(cc1)c1nnc(n1c1ccccc1)S |
| Stereo: | ACHIRAL |
| logP: | 3.0898 |
| logD: | 1.5472 |
| logSw: | -3.0585 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.4577 |
| InChI Key: | QGTQPTZBBLHLBV-UHFFFAOYSA-N |