ethyl 4-(2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | M043-0304 |
| Compound Name: | ethyl 4-(2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 463.57 |
| Molecular Formula: | C21 H25 N3 O5 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1ccc(nn1)S(C1CCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9805 |
| logD: | 3.9804 |
| logSw: | -3.8686 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.442 |
| InChI Key: | BPDOANGRNZWNCF-UHFFFAOYSA-N |