ethyl 2-(2-{[6-(4-methylbenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 2-(2-{[6-(4-methylbenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
ethyl 2-(2-{[6-(4-methylbenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | M043-0741 |
| Compound Name: | ethyl 2-(2-{[6-(4-methylbenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C22 H21 N3 O5 S2 |
| Smiles: | CCOC(c1ccccc1NC(CSc1ccc(nn1)S(c1ccc(C)cc1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7574 |
| logD: | 3.7409 |
| logSw: | -3.891 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.552 |
| InChI Key: | UGQIUIWKWRALBW-UHFFFAOYSA-N |