4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
Chemical Structure Depiction of
4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
Compound characteristics
| Compound ID: | E019-1142 |
| Compound Name: | 4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CC(C)Oc1ccc(CNC(CCCN2C(c3c4ccccc4sc3C(C)=N2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9133 |
| logD: | 3.9133 |
| logSw: | -4.1557 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.639 |
| InChI Key: | KIGTUAWGEVVPHE-UHFFFAOYSA-N |