4-(3-chlorophenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-(3-chlorophenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-(3-chlorophenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8015-6408 |
| Compound Name: | 4-(3-chlorophenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 288.76 |
| Molecular Formula: | C13 H9 Cl N4 S |
| Smiles: | c1cc(cc(c1)[Cl])N1C(c2ccncc2)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.9294 |
| logD: | 0.859 |
| logSw: | -3.6326 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.402 |
| InChI Key: | QNMAMRQMXGVQAA-UHFFFAOYSA-N |