2-{[5-(4-bromophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-bromophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
2-{[5-(4-bromophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | Y205-6479 |
| Compound Name: | 2-{[5-(4-bromophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide |
| Molecular Weight: | 447.35 |
| Molecular Formula: | C19 H19 Br N4 O2 S |
| Smiles: | CCn1c(c2ccc(cc2)[Br])nnc1SCC(Nc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4164 |
| logD: | 4.4164 |
| logSw: | -4.3564 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.047 |
| InChI Key: | NBSFJQHVAUYVHT-UHFFFAOYSA-N |