ethyl 3-(2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 3-(2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
ethyl 3-(2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | M043-1031 |
| Compound Name: | ethyl 3-(2-{[6-(3-fluorobenzene-1-sulfonyl)pyridazin-3-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C21 H18 F N3 O5 S2 |
| Smiles: | CCOC(c1cccc(c1)NC(CSc1ccc(nn1)S(c1cccc(c1)F)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8014 |
| logD: | 3.8014 |
| logSw: | -3.872 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.249 |
| InChI Key: | WJLLDQLCVOIELV-UHFFFAOYSA-N |