2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-({1-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]cyclohexyl}methyl)acetamide
Chemical Structure Depiction of
2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-({1-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]cyclohexyl}methyl)acetamide
2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-({1-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]cyclohexyl}methyl)acetamide
Compound characteristics
| Compound ID: | J102-0282 |
| Compound Name: | 2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)-N-({1-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]cyclohexyl}methyl)acetamide |
| Molecular Weight: | 448.57 |
| Molecular Formula: | C25 H32 N6 O2 |
| Smiles: | C1CCC2=CC(N(CC(NCC3(CCCCC3)Cc3nnc4ccccn34)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0034 |
| logD: | 2.0034 |
| logSw: | -2.3963 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.542 |
| InChI Key: | LCHKQWGCCSWQCJ-UHFFFAOYSA-N |