4-(5-{[1-(4-ethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(5-{[1-(4-ethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide
4-(5-{[1-(4-ethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4357-3432 |
| Compound Name: | 4-(5-{[1-(4-ethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 435.5 |
| Molecular Formula: | C23 H21 N3 O4 S |
| Smiles: | CCc1ccc(cc1)N1C(C(=C/c2ccc(c3ccc(cc3)S(N)(=O)=O)o2)\C(C)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0678 |
| logD: | 4.067 |
| logSw: | -4.1698 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.76 |
| InChI Key: | NMJJNSUMMCJLKT-UHFFFAOYSA-N |