2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-propylacetamide
Chemical Structure Depiction of
2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-propylacetamide
2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-propylacetamide
Compound characteristics
| Compound ID: | G731-0119 |
| Compound Name: | 2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-propylacetamide |
| Molecular Weight: | 276.36 |
| Molecular Formula: | C13 H16 N4 O S |
| Smiles: | CCCNC(CSc1nnc(c2ccccc2)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.504 |
| logD: | 0.3123 |
| logSw: | -2.2277 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.058 |
| InChI Key: | JQCMOPSSCFXWHA-UHFFFAOYSA-N |