5-benzyl-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-benzyl-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-benzyl-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 4670-0177 |
| Compound Name: | 5-benzyl-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 205.28 |
| Molecular Formula: | C10 H11 N3 S |
| Smiles: | CN1C(Cc2ccccc2)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.0758 |
| logD: | 2.0031 |
| logSw: | -2.0974 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.4779 |
| InChI Key: | MJOLNPWSILTXMX-UHFFFAOYSA-N |