N-(4-methylphenyl)-3-(6-{[2-(3-methylthiophen-2-yl)ethyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
Chemical Structure Depiction of
N-(4-methylphenyl)-3-(6-{[2-(3-methylthiophen-2-yl)ethyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
N-(4-methylphenyl)-3-(6-{[2-(3-methylthiophen-2-yl)ethyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
Compound characteristics
| Compound ID: | C747-0045 |
| Compound Name: | N-(4-methylphenyl)-3-(6-{[2-(3-methylthiophen-2-yl)ethyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide |
| Molecular Weight: | 420.54 |
| Molecular Formula: | C22 H24 N6 O S |
| Smiles: | Cc1ccc(cc1)NC(CCc1nnc2ccc(NCCc3c(C)ccs3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5241 |
| logD: | 3.5241 |
| logSw: | -3.64 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.184 |
| InChI Key: | ZLPTUSFWTFXWEZ-UHFFFAOYSA-N |