3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(2-chlorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(2-chlorophenyl)methyl]propanamide
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(2-chlorophenyl)methyl]propanamide
Compound characteristics
| Compound ID: | G395-1451 |
| Compound Name: | 3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(2-chlorophenyl)methyl]propanamide |
| Molecular Weight: | 464.91 |
| Molecular Formula: | C23 H21 Cl N6 O3 |
| Smiles: | C(Cc1nnc2ccc(NCc3ccc4c(c3)OCO4)nn12)C(NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8305 |
| logD: | 2.8305 |
| logSw: | -3.4332 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.762 |
| InChI Key: | ZFGXNKDVLSSUJI-UHFFFAOYSA-N |