ethyl 1-[3-({[6-(4-methylphenyl)pyridazin-3-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-({[6-(4-methylphenyl)pyridazin-3-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
ethyl 1-[3-({[6-(4-methylphenyl)pyridazin-3-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V010-4514 |
| Compound Name: | ethyl 1-[3-({[6-(4-methylphenyl)pyridazin-3-yl]sulfanyl}methyl)benzoyl]piperidine-3-carboxylate |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C27 H29 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCN(C1)C(c1cccc(CSc2ccc(c3ccc(C)cc3)nn2)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5703 |
| logD: | 4.5703 |
| logSw: | -4.4163 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.135 |
| InChI Key: | QDMSTIGAPPEEOZ-QHCPKHFHSA-N |