N-[2-(azepan-1-yl)ethyl]-1-(3-phenyl[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-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(3-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F707-3259 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(3-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C25 H33 N7 O |
| Smiles: | C1CCCN(CC1)CCNC(C1CCN(CC1)c1ccc2nnc(c3ccccc3)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1843 |
| logD: | 1.4016 |
| logSw: | -3.0427 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.881 |
| InChI Key: | FXDJFXPIHHPGAZ-UHFFFAOYSA-N |