N-[(3-ethoxyphenyl)methyl]-3-[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-[(3-ethoxyphenyl)methyl]-3-[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-[(3-ethoxyphenyl)methyl]-3-[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | M454-0664 |
| Compound Name: | N-[(3-ethoxyphenyl)methyl]-3-[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C24 H25 N5 O2 |
| Smiles: | CCOc1cccc(CNC(CCc2nnc3ccc(c4ccc(C)cc4)nn23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5017 |
| logD: | 3.5017 |
| logSw: | -3.5441 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.697 |
| InChI Key: | MLBBAKVFCNDXTD-UHFFFAOYSA-N |