2-phenyl-5-(propan-2-yl)-1,2-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
2-phenyl-5-(propan-2-yl)-1,2-dihydro-3H-1,2,4-triazole-3-thione
2-phenyl-5-(propan-2-yl)-1,2-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8009-8188 |
| Compound Name: | 2-phenyl-5-(propan-2-yl)-1,2-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 219.31 |
| Molecular Formula: | C11 H13 N3 S |
| Smiles: | CC(C)C1NN(C(N=1)=S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.293 |
| logD: | 2.293 |
| logSw: | -2.2139 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.3134 |
| InChI Key: | LJGXJWLGMAKTTJ-UHFFFAOYSA-N |