4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | K822-0009 |
| Compound Name: | 4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 218.28 |
| Molecular Formula: | C10 H10 N4 S |
| Smiles: | C=CCN1C(c2ccncc2)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 1.6495 |
| logD: | 1.2331 |
| logSw: | -1.6441 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.263 |
| InChI Key: | YDSITGDYTVXFBE-UHFFFAOYSA-N |