ethyl 1-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperidine-4-carboxylate
ethyl 1-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | E019-0869 |
| Compound Name: | ethyl 1-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperidine-4-carboxylate |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | CCOC(C1CCN(CC1)C(CCCN1C(c2c3ccccc3sc2C(C)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8647 |
| logD: | 2.8647 |
| logSw: | -3.0403 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.511 |
| InChI Key: | GLQIGDQODNNBRZ-UHFFFAOYSA-N |