3-(4-fluorophenyl)-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine
Chemical Structure Depiction of
3-(4-fluorophenyl)-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine
3-(4-fluorophenyl)-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine
Compound characteristics
| Compound ID: | C713-0268 |
| Compound Name: | 3-(4-fluorophenyl)-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine |
| Molecular Weight: | 483.48 |
| Molecular Formula: | C21 H18 F N7 O4 S |
| Smiles: | C1CN(CCN1c1ccc2nnc(c3ccc(cc3)F)n2n1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3873 |
| logD: | 3.3873 |
| logSw: | -3.8128 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 100.213 |
| InChI Key: | CMYWGUCZZBKMCU-UHFFFAOYSA-N |