2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]acetamide
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | D327-0078 |
| Compound Name: | 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxopyridazin-1(6H)-yl]-N-[4-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C21 H19 N3 O4 S |
| Smiles: | CSc1ccc(cc1)NC(CN1C(C=CC(c2ccc3c(c2)OCCO3)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7506 |
| logD: | 2.7506 |
| logSw: | -3.3483 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.52 |
| InChI Key: | GFODHYRYIDBBDB-UHFFFAOYSA-N |