2-{[4-ethyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[4-ethyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[4-ethyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C592-3830 |
| Compound Name: | 2-{[4-ethyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 352.41 |
| Molecular Formula: | C15 H20 N4 O4 S |
| Smiles: | CCn1c(c2cc(c(c(c2)OC)OC)OC)nnc1SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1507 |
| logD: | 1.1507 |
| logSw: | -1.9002 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.603 |
| InChI Key: | OEOPSQMMSJSFIU-UHFFFAOYSA-N |