N-(3-acetylphenyl)-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(3-acetylphenyl)-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L850-1875 |
| Compound Name: | N-(3-acetylphenyl)-2-{[4-methyl-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 434.48 |
| Molecular Formula: | C21 H18 N6 O3 S |
| Smiles: | CC(c1cccc(c1)NC(CSc1nnc(c2nc(c3ccccc3)no2)n1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1244 |
| logD: | 3.1243 |
| logSw: | -3.3296 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.704 |
| InChI Key: | CDMXKHBMGPYYGP-UHFFFAOYSA-N |