8-ethyl-3,6-dioxo-7H-3lambda~5~,6lambda~5~-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole
Chemical Structure Depiction of
8-ethyl-3,6-dioxo-7H-3lambda~5~,6lambda~5~-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole
8-ethyl-3,6-dioxo-7H-3lambda~5~,6lambda~5~-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole
Compound characteristics
| Compound ID: | 8013-3933 |
| Compound Name: | 8-ethyl-3,6-dioxo-7H-3lambda~5~,6lambda~5~-imidazo[4,5-e][1,2,5]oxadiazolo[3,4-g][2,1,3]benzoxadiazole |
| Molecular Weight: | 262.18 |
| Molecular Formula: | C9 H6 N6 O4 |
| Smiles: | CCc1nc2c3c(c4c(c2[nH]1)[n+]([O-])on4)[n+]([O-])on3 |
| Stereo: | ACHIRAL |
| logP: | 0.9499 |
| logD: | 0.9499 |
| logSw: | -0.9442 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.879 |
| InChI Key: | JCALPTOBMSSINF-UHFFFAOYSA-N |