ethyl 5-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrazole-4-carboxylate
ethyl 5-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | F421-0039 |
| Compound Name: | ethyl 5-{[3-(methylsulfanyl)phenyl]sulfamoyl}-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C13 H15 N3 O4 S2 |
| Smiles: | CCOC(c1cn[nH]c1S(Nc1cccc(c1)SC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6085 |
| logD: | 2.3957 |
| logSw: | -3.0667 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.878 |
| InChI Key: | UUBVDBRWBOPKDS-UHFFFAOYSA-N |