2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Chemical Structure Depiction of
2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Compound characteristics
| Compound ID: | Y041-1089 |
| Compound Name: | 2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C21 H26 N4 O2 |
| Smiles: | C1CCC2=CC(N(CC(N3CCN(CC3)c3ccccc3)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2126 |
| logD: | 2.2125 |
| logSw: | -2.4054 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.217 |
| InChI Key: | WDYOYGRCQWSUHH-UHFFFAOYSA-N |