N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzenesulfonamide
Chemical Structure Depiction of
N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzenesulfonamide
N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzenesulfonamide
Compound characteristics
| Compound ID: | E551-0097 |
| Compound Name: | N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzenesulfonamide |
| Molecular Weight: | 426.52 |
| Molecular Formula: | C19 H18 N6 O2 S2 |
| Smiles: | C(CNS(c1ccccc1)(=O)=O)c1nnc2ccc(nn12)SCc1cccnc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7221 |
| logD: | 1.6261 |
| logSw: | -2.1046 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.852 |
| InChI Key: | JXXMCHHZSDAJFM-UHFFFAOYSA-N |