4-(5-{[1-(4-chlorophenyl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(5-{[1-(4-chlorophenyl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide
4-(5-{[1-(4-chlorophenyl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4632-5770 |
| Compound Name: | 4-(5-{[1-(4-chlorophenyl)-5-oxo-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 495.86 |
| Molecular Formula: | C21 H13 Cl F3 N3 O4 S |
| Smiles: | C(=C1/C(C(F)(F)F)=NN(C1=O)c1ccc(cc1)[Cl])\c1ccc(c2ccc(cc2)S(N)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.178 |
| logD: | 4.1772 |
| logSw: | -4.6905 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.587 |
| InChI Key: | DRMBCDGPDAYZEI-UHFFFAOYSA-N |