4-[5-oxo-4-{[5-(4-sulfamoylphenyl)furan-2-yl]methylidene}-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-[5-oxo-4-{[5-(4-sulfamoylphenyl)furan-2-yl]methylidene}-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonamide
4-[5-oxo-4-{[5-(4-sulfamoylphenyl)furan-2-yl]methylidene}-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4545-1528 |
| Compound Name: | 4-[5-oxo-4-{[5-(4-sulfamoylphenyl)furan-2-yl]methylidene}-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzene-1-sulfonamide |
| Molecular Weight: | 540.5 |
| Molecular Formula: | C21 H15 F3 N4 O6 S2 |
| Smiles: | C(=C1/C(C(F)(F)F)=NN(C1=O)c1ccc(cc1)S(N)(=O)=O)\c1ccc(c2ccc(cc2)S(N)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 1.9438 |
| logD: | 1.9427 |
| logSw: | -2.5226 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 135.19 |
| InChI Key: | ZBGJYRLZFWKQTM-UHFFFAOYSA-N |