N-{3-[methyl(phenyl)amino]propyl}-1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-{3-[methyl(phenyl)amino]propyl}-1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
N-{3-[methyl(phenyl)amino]propyl}-1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F707-2457 |
| Compound Name: | N-{3-[methyl(phenyl)amino]propyl}-1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide |
| Molecular Weight: | 483.62 |
| Molecular Formula: | C28 H33 N7 O |
| Smiles: | Cc1cccc(c1)c1nnc2ccc(nn12)N1CCC(CC1)C(NCCCN(C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8319 |
| logD: | 3.8263 |
| logSw: | -3.7629 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.772 |
| InChI Key: | XNSNSDAPPDPAQZ-UHFFFAOYSA-N |