6-phenyl-3-(prop-2-yn-1-yl)-6,7-dihydro-3H-imidazo[1,5-b][1,2,4]triazole-2,5-dione
Chemical Structure Depiction of
6-phenyl-3-(prop-2-yn-1-yl)-6,7-dihydro-3H-imidazo[1,5-b][1,2,4]triazole-2,5-dione
6-phenyl-3-(prop-2-yn-1-yl)-6,7-dihydro-3H-imidazo[1,5-b][1,2,4]triazole-2,5-dione
Compound characteristics
| Compound ID: | 8019-7000 |
| Compound Name: | 6-phenyl-3-(prop-2-yn-1-yl)-6,7-dihydro-3H-imidazo[1,5-b][1,2,4]triazole-2,5-dione |
| Molecular Weight: | 254.25 |
| Molecular Formula: | C13 H10 N4 O2 |
| Smiles: | C#CCN1C(N=C2CN(C(N12)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1172 |
| logD: | 1.1138 |
| logSw: | -1.9305 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.587 |
| InChI Key: | VBNUPJSFUDGQHJ-UHFFFAOYSA-N |