2-(5-acetyl-1H-1,2,4-triazol-1-yl)-1-phenylethan-1-one
Chemical Structure Depiction of
2-(5-acetyl-1H-1,2,4-triazol-1-yl)-1-phenylethan-1-one
2-(5-acetyl-1H-1,2,4-triazol-1-yl)-1-phenylethan-1-one
Compound characteristics
| Compound ID: | 8006-2403 |
| Compound Name: | 2-(5-acetyl-1H-1,2,4-triazol-1-yl)-1-phenylethan-1-one |
| Molecular Weight: | 229.24 |
| Molecular Formula: | C12 H11 N3 O2 |
| Smiles: | CC(c1ncnn1CC(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6093 |
| logD: | 0.6093 |
| logSw: | -1.4942 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.039 |
| InChI Key: | YATSQSIFOSDEBL-UHFFFAOYSA-N |