2-[(4-benzylpiperidin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Chemical Structure Depiction of
2-[(4-benzylpiperidin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
2-[(4-benzylpiperidin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Compound characteristics
| Compound ID: | Y041-5666 |
| Compound Name: | 2-[(4-benzylpiperidin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one |
| Molecular Weight: | 351.49 |
| Molecular Formula: | C22 H29 N3 O |
| Smiles: | C1CCC2=CC(N(CN3CCC(CC3)Cc3ccccc3)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3916 |
| logD: | 3.0835 |
| logSw: | -4.3568 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.719 |
| InChI Key: | GNWOQHVBMJFDLB-UHFFFAOYSA-N |