ethyl 4-[2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperazine-1-carboxylate
ethyl 4-[2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | E019-0590 |
| Compound Name: | ethyl 4-[2-(4-methyl-1-oxo[1]benzothieno[2,3-d]pyridazin-2(1H)-yl)butanoyl]piperazine-1-carboxylate |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C22 H26 N4 O4 S |
| Smiles: | CCC(C(N1CCN(CC1)C(=O)OCC)=O)N1C(c2c3ccccc3sc2C(C)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6146 |
| logD: | 3.6146 |
| logSw: | -3.8038 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.204 |
| InChI Key: | XWQGXJYWNKIZOT-INIZCTEOSA-N |