2-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-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-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethyl)-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
2-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethyl)-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Compound characteristics
| Compound ID: | J102-0350 |
| Compound Name: | 2-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethyl)-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C22 H29 N5 O2 |
| Smiles: | C1CCC2=CC(N(CC(N3CCN(CCc4ccccn4)CC3)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1355 |
| logD: | 1.1151 |
| logSw: | -1.8254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.018 |
| InChI Key: | ZKEXAEIYIRUOTD-UHFFFAOYSA-N |