2-({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dimethoxyphenyl)acetamide
2-({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | Y207-4472 |
| Compound Name: | 2-({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 448.93 |
| Molecular Formula: | C20 H21 Cl N4 O4 S |
| Smiles: | Cn1c(COc2ccccc2[Cl])nnc1SCC(Nc1cc(ccc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7112 |
| logD: | 2.7107 |
| logSw: | -3.4378 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.239 |
| InChI Key: | XKROURKKBBHTBG-UHFFFAOYSA-N |