2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]propanamide
Chemical Structure Depiction of
2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]propanamide
2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]propanamide
Compound characteristics
| Compound ID: | G117-0592 |
| Compound Name: | 2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]propanamide |
| Molecular Weight: | 463.48 |
| Molecular Formula: | C22 H20 F3 N3 O3 S |
| Smiles: | CC(C(Nc1ccc(cc1)OC(F)(F)F)=O)SC1C=CC(N(c2ccc(C)c(C)c2)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8351 |
| logD: | 5.8351 |
| logSw: | -5.4815 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.847 |
| InChI Key: | AZDQBQHIWGUBTN-HNNXBMFYSA-N |