4-[2-({[1-(4-nitrophenyl)-5-oxo-3-propyl-4,5-dihydro-1H-pyrazol-4-yl]methylidene}amino)ethyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-[2-({[1-(4-nitrophenyl)-5-oxo-3-propyl-4,5-dihydro-1H-pyrazol-4-yl]methylidene}amino)ethyl]benzene-1-sulfonamide
4-[2-({[1-(4-nitrophenyl)-5-oxo-3-propyl-4,5-dihydro-1H-pyrazol-4-yl]methylidene}amino)ethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5236-0053 |
| Compound Name: | 4-[2-({[1-(4-nitrophenyl)-5-oxo-3-propyl-4,5-dihydro-1H-pyrazol-4-yl]methylidene}amino)ethyl]benzene-1-sulfonamide |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C21 H23 N5 O5 S |
| Smiles: | CCCC1C(/C=N/CCc2ccc(cc2)S(N)(=O)=O)C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2986 |
| logD: | 2.0826 |
| logSw: | -2.5457 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 119.077 |
| InChI Key: | HWXWVZYSOAANSO-IBGZPJMESA-N |