2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(4-propoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(4-propoxyphenyl)methyl]butanamide
2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(4-propoxyphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | E019-0861 |
| Compound Name: | 2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)-N-[(4-propoxyphenyl)methyl]butanamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CCCOc1ccc(CNC(C(CC)N2C(c3c4ccccc4sc3C(C)=N2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2987 |
| logD: | 5.2987 |
| logSw: | -5.5238 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.607 |
| InChI Key: | NIRMPIYGYNEIOE-FQEVSTJZSA-N |