2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide
2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | G117-0586 |
| Compound Name: | 2-{[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 387.5 |
| Molecular Formula: | C20 H25 N3 O3 S |
| Smiles: | CC(C(NCC1CCCO1)=O)SC1C=CC(N(c2ccc(C)c(C)c2)N=1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0369 |
| logD: | 3.0369 |
| logSw: | -3.2218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.887 |
| InChI Key: | QZSOEDPDFCVLFK-UHFFFAOYSA-N |