ethyl 1-(4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzoyl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzoyl)piperidine-4-carboxylate
ethyl 1-(4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzoyl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | F616-0674 |
| Compound Name: | ethyl 1-(4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzoyl)piperidine-4-carboxylate |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C26 H27 N3 O4 S |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc(cc1)N1C(C=CC(=N1)Sc1ccc(C)cc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0396 |
| logD: | 4.0396 |
| logSw: | -3.9545 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.95 |
| InChI Key: | JQOLGTXKCVJOCF-UHFFFAOYSA-N |