2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]propanamide
Chemical Structure Depiction of
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]propanamide
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]propanamide
Compound characteristics
| Compound ID: | D327-0103 |
| Compound Name: | 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]propanamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C22 H21 N3 O4 S |
| Smiles: | CC(C(Nc1ccc(cc1)SC)=O)N1C(C=CC(c2ccc3c(c2)OCCO3)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0243 |
| logD: | 3.0243 |
| logSw: | -3.5294 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.267 |
| InChI Key: | MUOHAIDBWFBGNT-AWEZNQCLSA-N |