2-{2-cyano-3-[5-(4-sulfamoylphenyl)furan-2-yl]prop-2-enamido}benzoic acid
Chemical Structure Depiction of
2-{2-cyano-3-[5-(4-sulfamoylphenyl)furan-2-yl]prop-2-enamido}benzoic acid
2-{2-cyano-3-[5-(4-sulfamoylphenyl)furan-2-yl]prop-2-enamido}benzoic acid
Compound characteristics
| Compound ID: | 3681-3715 |
| Compound Name: | 2-{2-cyano-3-[5-(4-sulfamoylphenyl)furan-2-yl]prop-2-enamido}benzoic acid |
| Molecular Weight: | 437.43 |
| Molecular Formula: | C21 H15 N3 O6 S |
| Smiles: | C(=C(/C#N)C(Nc1ccccc1C(O)=O)=O)/c1ccc(c2ccc(cc2)S(N)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2827 |
| logD: | -1.1345 |
| logSw: | -3.8518 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 126.269 |
| InChI Key: | AZKKSEZBSLUNBI-UHFFFAOYSA-N |