8,10-dinitrobenzo[b][1,2,3]triazolo[4,5,1-jk][1,5]benzodiazepin-7(6H)-one
Chemical Structure Depiction of
8,10-dinitrobenzo[b][1,2,3]triazolo[4,5,1-jk][1,5]benzodiazepin-7(6H)-one
8,10-dinitrobenzo[b][1,2,3]triazolo[4,5,1-jk][1,5]benzodiazepin-7(6H)-one
Compound characteristics
| Compound ID: | 8017-9998 |
| Compound Name: | 8,10-dinitrobenzo[b][1,2,3]triazolo[4,5,1-jk][1,5]benzodiazepin-7(6H)-one |
| Molecular Weight: | 326.22 |
| Molecular Formula: | C13 H6 N6 O5 |
| Smiles: | c1cc2c3c(c1)nnn3c1cc(cc(c1C(N2)=O)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.736 |
| logD: | -0.6099 |
| logSw: | -2.361 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 115.905 |
| InChI Key: | WBZQLAHXNMGNGC-UHFFFAOYSA-N |