N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
Chemical Structure Depiction of
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide
Compound characteristics
| Compound ID: | Y043-2038 |
| Compound Name: | N-(6-methoxy-1,3-benzothiazol-2-yl)-2-{3-[4-(methylsulfanyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetamide |
| Molecular Weight: | 438.53 |
| Molecular Formula: | C21 H18 N4 O3 S2 |
| Smiles: | COc1ccc2c(c1)sc(NC(CN1C(C=CC(c3ccc(cc3)SC)=N1)=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.5585 |
| logD: | 4.5585 |
| logSw: | -4.4585 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.002 |
| InChI Key: | WSZRFJCNTWXAHF-UHFFFAOYSA-N |