5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8008-6412 |
| Compound Name: | 5-[(naphthalen-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 317.41 |
| Molecular Formula: | C19 H15 N3 S |
| Smiles: | C(c1cccc2ccccc12)c1nnc(n1c1ccccc1)S |
| Stereo: | ACHIRAL |
| logP: | 4.0124 |
| logD: | 2.7532 |
| logSw: | -4.3415 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.1623 |
| InChI Key: | HIUZRQOFJKBKDH-UHFFFAOYSA-N |