5-benzyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-benzyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-benzyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8006-6695 |
| Compound Name: | 5-benzyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 191.25 |
| Molecular Formula: | C9 H9 N3 S |
| Smiles: | C(C1NC(NN=1)=S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0023 |
| logD: | 0.6559 |
| logSw: | -1.9722 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.409 |
| InChI Key: | MAGFPLALYSZUTR-UHFFFAOYSA-N |