N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F707-2095 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide |
| Molecular Weight: | 470.53 |
| Molecular Formula: | C26 H26 N6 O3 |
| Smiles: | Cc1ccccc1c1nnc2ccc(nn12)N1CCC(CC1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3706 |
| logD: | 3.3706 |
| logSw: | -3.5926 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.842 |
| InChI Key: | WIPBRIMYUBXIJM-UHFFFAOYSA-N |