N-[(4-chlorophenyl)methyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-[(4-chlorophenyl)methyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y205-9885 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 296.78 |
| Molecular Formula: | C12 H13 Cl N4 O S |
| Smiles: | Cn1cnnc1SCC(NCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4718 |
| logD: | 1.4718 |
| logSw: | -2.7835 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.204 |
| InChI Key: | JSUSVCHTDLWMBJ-UHFFFAOYSA-N |