1-(4-benzylpiperazin-1-yl)-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(4-benzylpiperazin-1-yl)-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]ethan-1-one
1-(4-benzylpiperazin-1-yl)-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | E860-2795 |
| Compound Name: | 1-(4-benzylpiperazin-1-yl)-2-[(3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C26 H28 N6 O S |
| Smiles: | Cc1c2c(c(nn1)SCC(N1CCN(CC1)Cc1ccccc1)=O)nn(c1ccccc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 2.9654 |
| logD: | 2.9556 |
| logSw: | -3.2683 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.678 |
| InChI Key: | VKLPKIDIIGVPKG-UHFFFAOYSA-N |