N-[(3,4-dimethoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
N-[(3,4-dimethoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Compound characteristics
| Compound ID: | Y041-0366 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide |
| Molecular Weight: | 371.43 |
| Molecular Formula: | C20 H25 N3 O4 |
| Smiles: | COc1ccc(CNC(CN2C(C=C3CCCCCC3=N2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.8203 |
| logD: | 1.8203 |
| logSw: | -2.4519 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.296 |
| InChI Key: | DTZRXWZAAYNYNF-UHFFFAOYSA-N |