4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | F978-0711 |
| Compound Name: | 4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 435.55 |
| Molecular Formula: | C23 H25 N5 O2 S |
| Smiles: | Cc1ccc(cc1)N1C(C=CC(=N1)N1CCN(CC1)C(Nc1cccc(c1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.52 |
| logD: | 3.5199 |
| logSw: | -3.7577 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.982 |
| InChI Key: | CCZBBIZNXFKVQL-UHFFFAOYSA-N |