ethyl {[5-(furan-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[5-(furan-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[5-(furan-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y206-3155 |
| Compound Name: | ethyl {[5-(furan-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 295.36 |
| Molecular Formula: | C13 H17 N3 O3 S |
| Smiles: | CCOC(CSc1nnc(c2ccco2)n1C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2522 |
| logD: | 2.2493 |
| logSw: | -2.3954 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.325 |
| InChI Key: | ONZWNODCFOLFRP-UHFFFAOYSA-N |