N-[2-(2,5-dimethoxyphenyl)ethyl]-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
Chemical Structure Depiction of
N-[2-(2,5-dimethoxyphenyl)ethyl]-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
N-[2-(2,5-dimethoxyphenyl)ethyl]-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
Compound characteristics
| Compound ID: | G395-0983 |
| Compound Name: | N-[2-(2,5-dimethoxyphenyl)ethyl]-3-(6-{[(pyridin-3-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C24 H27 N7 O3 |
| Smiles: | COc1ccc(c(CCNC(CCc2nnc3ccc(NCc4cccnc4)nn23)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.0318 |
| logD: | 1.0026 |
| logSw: | -1.3634 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.18 |
| InChI Key: | PRQSUOHMNGCVLZ-UHFFFAOYSA-N |