N-(3-fluorophenyl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(3-fluorophenyl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8012-6855 |
| Compound Name: | N-(3-fluorophenyl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 358.39 |
| Molecular Formula: | C17 H15 F N4 O2 S |
| Smiles: | C=CCn1c(c2ccco2)nnc1SCC(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1441 |
| logD: | 3.1439 |
| logSw: | -3.295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.947 |
| InChI Key: | WERKWYOSCWYONN-UHFFFAOYSA-N |