{[4-ethyl-5-(2-methylfuran-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetonitrile
Chemical Structure Depiction of
{[4-ethyl-5-(2-methylfuran-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetonitrile
{[4-ethyl-5-(2-methylfuran-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetonitrile
Compound characteristics
| Compound ID: | 8018-5638 |
| Compound Name: | {[4-ethyl-5-(2-methylfuran-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetonitrile |
| Molecular Weight: | 248.3 |
| Molecular Formula: | C11 H12 N4 O S |
| Smiles: | CCn1c(c2ccoc2C)nnc1SCC#N |
| Stereo: | ACHIRAL |
| logP: | 1.5973 |
| logD: | 1.5973 |
| logSw: | -2.3585 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.962 |
| InChI Key: | QAVDGVURMQAGDJ-UHFFFAOYSA-N |