2-{[5-(5-chloro-2-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(5-chloro-2-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(5-chloro-2-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-9097 |
| Compound Name: | 2-{[5-(5-chloro-2-methoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 312.78 |
| Molecular Formula: | C12 H13 Cl N4 O2 S |
| Smiles: | Cn1c(c2cc(ccc2OC)[Cl])nnc1SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3282 |
| logD: | 1.3281 |
| logSw: | -2.7346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.341 |
| InChI Key: | OWDRGHUGHXSRGR-UHFFFAOYSA-N |