4-{4-[(4-ethoxy-3-methoxy-5-nitrophenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-{4-[(4-ethoxy-3-methoxy-5-nitrophenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzene-1-sulfonamide
4-{4-[(4-ethoxy-3-methoxy-5-nitrophenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3448-8682 |
| Compound Name: | 4-{4-[(4-ethoxy-3-methoxy-5-nitrophenyl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzene-1-sulfonamide |
| Molecular Weight: | 460.46 |
| Molecular Formula: | C20 H20 N4 O7 S |
| Smiles: | CCOc1c(cc(\C=C2/C(C)=NN(C2=O)c2ccc(cc2)S(N)(=O)=O)cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.117 |
| logD: | 2.1159 |
| logSw: | -2.8759 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 124.198 |
| InChI Key: | GWQDVYCXOMRCAG-UHFFFAOYSA-N |