3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[2-(2,5-dimethoxyphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[2-(2,5-dimethoxyphenyl)ethyl]propanamide
3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[2-(2,5-dimethoxyphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | G395-0694 |
| Compound Name: | 3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[2-(2,5-dimethoxyphenyl)ethyl]propanamide |
| Molecular Weight: | 494.98 |
| Molecular Formula: | C25 H27 Cl N6 O3 |
| Smiles: | COc1ccc(c(CCNC(CCc2nnc3ccc(NCc4ccccc4[Cl])nn23)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0416 |
| logD: | 3.0416 |
| logSw: | -3.4306 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.662 |
| InChI Key: | ROERNVSKXVQJDL-UHFFFAOYSA-N |