4-[(furan-2-yl)methyl]-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-[(furan-2-yl)methyl]-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-[(furan-2-yl)methyl]-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 6516-0013 |
| Compound Name: | 4-[(furan-2-yl)methyl]-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 257.31 |
| Molecular Formula: | C13 H11 N3 O S |
| Smiles: | C(c1ccco1)N1C(c2ccccc2)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.163 |
| logD: | 2.9349 |
| logSw: | -3.1689 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.334 |
| InChI Key: | NDCSGOMBRRCQMS-UHFFFAOYSA-N |