2-({5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
2-({5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
2-({5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y205-9086 |
| Compound Name: | 2-({5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 326.8 |
| Molecular Formula: | C13 H15 Cl N4 O2 S |
| Smiles: | Cc1cc(ccc1[Cl])OCc1nnc(n1C)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7514 |
| logD: | 1.7514 |
| logSw: | -2.7849 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.186 |
| InChI Key: | HMTYKQAFTVOIPK-UHFFFAOYSA-N |