N-[(3-methylphenyl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
N-[(3-methylphenyl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F707-2113 |
| Compound Name: | N-[(3-methylphenyl)methyl]-1-[3-(2-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide |
| Molecular Weight: | 440.55 |
| Molecular Formula: | C26 H28 N6 O |
| Smiles: | Cc1cccc(CNC(C2CCN(CC2)c2ccc3nnc(c4ccccc4C)n3n2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.146 |
| logD: | 4.146 |
| logSw: | -4.2013 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.726 |
| InChI Key: | LLPRFVNKFRLEFE-UHFFFAOYSA-N |