7-(4-methylphenyl)-6-oxo-5,7-dihydro-4H-6lambda~5~-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole
Chemical Structure Depiction of
7-(4-methylphenyl)-6-oxo-5,7-dihydro-4H-6lambda~5~-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole
7-(4-methylphenyl)-6-oxo-5,7-dihydro-4H-6lambda~5~-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole
Compound characteristics
| Compound ID: | 3454-1886 |
| Compound Name: | 7-(4-methylphenyl)-6-oxo-5,7-dihydro-4H-6lambda~5~-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole |
| Molecular Weight: | 269.26 |
| Molecular Formula: | C13 H11 N5 O2 |
| Smiles: | Cc1ccc(cc1)n1nc2c3c(CCc2[n+]1[O-])non3 |
| Stereo: | ACHIRAL |
| logP: | 2.5352 |
| logD: | 2.5352 |
| logSw: | -2.447 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 72.659 |
| InChI Key: | FUYWSXHEJAWYOS-UHFFFAOYSA-N |