2-{[5-(4-bromo-5-ethylthiophen-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(4-bromo-5-ethylthiophen-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(4-bromo-5-ethylthiophen-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y502-3710 |
| Compound Name: | 2-{[5-(4-bromo-5-ethylthiophen-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 375.31 |
| Molecular Formula: | C12 H15 Br N4 O S2 |
| Smiles: | CCc1c(cc(c2nnc(n2CC)SCC(N)=O)s1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.9705 |
| logD: | 2.9701 |
| logSw: | -3.1281 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.643 |
| InChI Key: | APVJSBXQTOIFJC-UHFFFAOYSA-N |