ethyl {[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y206-1289 |
| Compound Name: | ethyl {[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 292.36 |
| Molecular Formula: | C13 H16 N4 O2 S |
| Smiles: | CCn1c(c2cccnc2)nnc1SCC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 1.56 |
| logD: | 1.5433 |
| logSw: | -1.4484 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.914 |
| InChI Key: | XSZARZCOZJABNO-UHFFFAOYSA-N |