2-(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
2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-({4-[(propan-2-yl)oxy]phenyl}methyl)butanamide
2-(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: | E019-0862 |
| Compound Name: | 2-(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: | CCC(C(NCc1ccc(cc1)OC(C)C)=O)N1C(c2c3ccccc3sc2C(C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0059 |
| logD: | 5.0059 |
| logSw: | -4.838 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.992 |
| InChI Key: | ZGWXIOSIFWRAMF-FQEVSTJZSA-N |