N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2,6-dimethoxypyridine-3-carboxamide
Chemical Structure Depiction of
N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2,6-dimethoxypyridine-3-carboxamide
N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2,6-dimethoxypyridine-3-carboxamide
Compound characteristics
| Compound ID: | S554-0492 |
| Compound Name: | N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2,6-dimethoxypyridine-3-carboxamide |
| Molecular Weight: | 408.39 |
| Molecular Formula: | C20 H17 F N6 O3 |
| Smiles: | COc1ccc(C(NCc2nnc3ccc(c4ccc(cc4)F)nn23)=O)c(n1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1212 |
| logD: | 3.1208 |
| logSw: | -3.3596 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.148 |
| InChI Key: | FHBOQMCYOLOFFJ-UHFFFAOYSA-N |