N-[2-(3,4-diethoxyphenyl)ethyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
N-[2-(3,4-diethoxyphenyl)ethyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide
Compound characteristics
| Compound ID: | E591-0485 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-3-[6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propanamide |
| Molecular Weight: | 481.6 |
| Molecular Formula: | C25 H35 N7 O3 |
| Smiles: | CCOc1ccc(CCNC(CCc2nnc3ccc(nn23)N2CCN(C)CC2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 0.7396 |
| logD: | 0.1686 |
| logSw: | -2.0967 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.499 |
| InChI Key: | BSIRLSSDPNTGCW-UHFFFAOYSA-N |