N-(2-nitrophenyl)-4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2-nitrophenyl)-4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazine-1-carboxamide
N-(2-nitrophenyl)-4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | C713-0299 |
| Compound Name: | N-(2-nitrophenyl)-4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazine-1-carboxamide |
| Molecular Weight: | 368.35 |
| Molecular Formula: | C16 H16 N8 O3 |
| Smiles: | C1CN(CCN1C(Nc1ccccc1[N+]([O-])=O)=O)c1ccc2nncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 1.6107 |
| logD: | 1.6099 |
| logSw: | -2.1043 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.895 |
| InChI Key: | GXXLTGIBLWUJGP-UHFFFAOYSA-N |