2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide
Chemical Structure Depiction of
2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide
2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | J102-0099 |
| Compound Name: | 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]acetamide |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C18 H20 N6 O2 |
| Smiles: | C1CCC2=CC(N(CC(NCc3nnc4ccccn34)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5172 |
| logD: | 0.5172 |
| logSw: | -1.7986 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.622 |
| InChI Key: | PEPNFZXHYCEPKV-UHFFFAOYSA-N |