ethyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
ethyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-0142 |
| Compound Name: | ethyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C20 H20 N4 O3 S |
| Smiles: | CCOC(c1cnn(c2ccc(cc2)C(Nc2cccc(c2)SC)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6093 |
| logD: | 3.6091 |
| logSw: | -3.8222 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.399 |
| InChI Key: | VHLHFLPMJJZDNN-UHFFFAOYSA-N |