ethyl 4-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
ethyl 4-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
Compound characteristics
| Compound ID: | 3697-0136 |
| Compound Name: | ethyl 4-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate |
| Molecular Weight: | 479.51 |
| Molecular Formula: | C24 H21 N3 O6 S |
| Smiles: | CCOC(c1ccc(cc1)c1ccc(/C=C2/C(C)=NN(C2=O)c2ccc(cc2)S(N)(=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7385 |
| logD: | 3.7375 |
| logSw: | -4.0777 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.513 |
| InChI Key: | RPMUFUXYAVBJLO-UHFFFAOYSA-N |