2-methoxy-4-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenyl thiophene-2-carboxylate
Chemical Structure Depiction of
2-methoxy-4-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenyl thiophene-2-carboxylate
2-methoxy-4-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 4588-0071 |
| Compound Name: | 2-methoxy-4-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenyl thiophene-2-carboxylate |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C23 H19 N3 O6 S2 |
| Smiles: | CC1/C(=C\c2ccc(c(c2)OC)OC(c2cccs2)=O)C(N(c2ccc(cc2)S(N)(=O)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9606 |
| logD: | 2.9595 |
| logSw: | -3.6127 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.303 |
| InChI Key: | FTNTUTIIDNFALQ-UHFFFAOYSA-N |