3-methyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine
Chemical Structure Depiction of
3-methyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine
3-methyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine
Compound characteristics
| Compound ID: | C713-0327 |
| Compound Name: | 3-methyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-b]pyridazine |
| Molecular Weight: | 403.42 |
| Molecular Formula: | C16 H17 N7 O4 S |
| Smiles: | Cc1nnc2ccc(nn12)N1CCN(CC1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3219 |
| logD: | 1.3218 |
| logSw: | -2.3815 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 101.262 |
| InChI Key: | DAOJRAHCJQXMIF-UHFFFAOYSA-N |