2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-methyl-N-phenylacetamide
Chemical Structure Depiction of
2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-methyl-N-phenylacetamide
2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-methyl-N-phenylacetamide
Compound characteristics
| Compound ID: | G731-0236 |
| Compound Name: | 2-{[5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-methyl-N-phenylacetamide |
| Molecular Weight: | 358.85 |
| Molecular Formula: | C17 H15 Cl N4 O S |
| Smiles: | CN(C(CSc1nnc(c2ccccc2[Cl])[nH]1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.571 |
| logD: | 1.3793 |
| logSw: | -3.494 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.587 |
| InChI Key: | NRQZCPAPCXFEOS-UHFFFAOYSA-N |