ethyl {[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y206-0251 |
| Compound Name: | ethyl {[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 321.4 |
| Molecular Formula: | C15 H19 N3 O3 S |
| Smiles: | CCn1c(c2ccc(cc2)OC)nnc1SCC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.0229 |
| logD: | 3.0228 |
| logSw: | -3.1498 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.939 |
| InChI Key: | RSAUGBNJBLIMHT-UHFFFAOYSA-N |