4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8019-9013 |
| Compound Name: | 4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 281.38 |
| Molecular Formula: | C16 H15 N3 S |
| Smiles: | C(Cc1nnc(n1c1ccccc1)S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3417 |
| logD: | 1.584 |
| logSw: | -3.3553 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.4339 |
| InChI Key: | VXCWKKYFAOEINW-UHFFFAOYSA-N |