N-[(4-methoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
N-[(4-methoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Compound characteristics
| Compound ID: | J102-0124 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C19 H23 N3 O3 |
| Smiles: | COc1ccc(CNC(CN2C(C=C3CCCCCC3=N2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1877 |
| logD: | 2.1877 |
| logSw: | -2.6932 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.579 |
| InChI Key: | WCXOCTXREFWLDE-UHFFFAOYSA-N |