3-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6-oxo-5,6-dihydropyridazin-1(4H)-yl}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6-oxo-5,6-dihydropyridazin-1(4H)-yl}-1lambda~6~-thiolane-1,1-dione
3-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6-oxo-5,6-dihydropyridazin-1(4H)-yl}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | Y041-4394 |
| Compound Name: | 3-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6-oxo-5,6-dihydropyridazin-1(4H)-yl}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 422.48 |
| Molecular Formula: | C19 H23 F N4 O4 S |
| Smiles: | C1CS(CC1N1C(CCC(C(N2CCN(CC2)c2ccc(cc2)F)=O)=N1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4515 |
| logD: | 0.4515 |
| logSw: | -1.9533 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.579 |
| InChI Key: | KOHIRARPWWFEIY-MRXNPFEDSA-N |