5-(furan-2-yl)-4-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(furan-2-yl)-4-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(furan-2-yl)-4-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | K822-0421 |
| Compound Name: | 5-(furan-2-yl)-4-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 257.31 |
| Molecular Formula: | C13 H11 N3 O S |
| Smiles: | Cc1ccc(cc1)N1C(c2ccco2)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.0614 |
| logD: | 2.2794 |
| logSw: | -3.2654 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.552 |
| InChI Key: | LNAPTKKFFQVWLE-UHFFFAOYSA-N |