ethyl 4-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamido]piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamido]piperidine-1-carboxylate
ethyl 4-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamido]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E019-0920 |
| Compound Name: | ethyl 4-[4-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanamido]piperidine-1-carboxylate |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C23 H28 N4 O4 S |
| Smiles: | CCOC(N1CCC(CC1)NC(CCCN1C(c2c3ccccc3sc2C(C)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6445 |
| logD: | 2.6445 |
| logSw: | -2.9435 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.342 |
| InChI Key: | ZJAXOROUBCBUIH-UHFFFAOYSA-N |