N-(2H-1,3-benzodioxol-5-yl)-3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
N-(2H-1,3-benzodioxol-5-yl)-3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
Compound characteristics
Compound ID: | G395-0719 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-(6-{[(2-chlorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide |
Molecular Weight: | 450.88 |
Molecular Formula: | C22 H19 Cl N6 O3 |
Smiles: | C(Cc1nnc2ccc(NCc3ccccc3[Cl])nn12)C(Nc1ccc2c(c1)OCO2)=O |
Stereo: | ACHIRAL |
logP: | 3.0502 |
logD: | 3.0501 |
logSw: | -3.4517 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 84.44 |
InChI Key: | VUJDJWWGTRISKW-UHFFFAOYSA-N |