N-[3-(azepan-1-yl)propyl]-2-(6-benzyl-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl)acetamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-2-(6-benzyl-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl)acetamide
N-[3-(azepan-1-yl)propyl]-2-(6-benzyl-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl)acetamide
Compound characteristics
| Compound ID: | C891-0209 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-2-(6-benzyl-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl)acetamide |
| Molecular Weight: | 449.6 |
| Molecular Formula: | C26 H35 N5 O2 |
| Smiles: | Cc1c2C=NN(CC(NCCCN3CCCCCC3)=O)C(c2c(C)n1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4197 |
| logD: | -0.2089 |
| logSw: | -2.7159 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.554 |
| InChI Key: | DXBWOELBDRUOOT-UHFFFAOYSA-N |