2-[(4-phenylpiperazin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Chemical Structure Depiction of
2-[(4-phenylpiperazin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
2-[(4-phenylpiperazin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Compound characteristics
| Compound ID: | Y041-5663 |
| Compound Name: | 2-[(4-phenylpiperazin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one |
| Molecular Weight: | 338.45 |
| Molecular Formula: | C20 H26 N4 O |
| Smiles: | C1CCC2=CC(N(CN3CCN(CC3)c3ccccc3)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9841 |
| logD: | 2.8227 |
| logSw: | -3.1895 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.25 |
| InChI Key: | VOCOHGWQYOVIIX-UHFFFAOYSA-N |