N-[2-(azepan-1-yl)ethyl]-1-[3-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-[3-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-[3-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F707-2647 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-[3-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]piperidine-4-carboxamide |
| Molecular Weight: | 461.61 |
| Molecular Formula: | C26 H35 N7 O |
| Smiles: | Cc1ccc(cc1)c1nnc2ccc(nn12)N1CCC(CC1)C(NCCN1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7127 |
| logD: | 1.9301 |
| logSw: | -3.5996 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.881 |
| InChI Key: | LHXYTTIDKBEADO-UHFFFAOYSA-N |