4-methyl-N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-methyl-N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzene-1-sulfonamide
4-methyl-N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E551-0216 |
| Compound Name: | 4-methyl-N-[2-(6-{[(pyridin-3-yl)methyl]sulfanyl}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]benzene-1-sulfonamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C20 H20 N6 O2 S2 |
| Smiles: | Cc1ccc(cc1)S(NCCc1nnc2ccc(nn12)SCc1cccnc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3305 |
| logD: | 2.2345 |
| logSw: | -2.3411 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.852 |
| InChI Key: | VQEAHKLCTUIHGS-UHFFFAOYSA-N |