methyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
methyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-1088 |
| Compound Name: | methyl 5-amino-1-(4-{[3-(methylsulfanyl)phenyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 382.44 |
| Molecular Formula: | C19 H18 N4 O3 S |
| Smiles: | COC(c1cnn(c2ccc(cc2)C(Nc2cccc(c2)SC)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0656 |
| logD: | 3.0655 |
| logSw: | -3.5804 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.82 |
| InChI Key: | IJPSABSGYHAUTA-UHFFFAOYSA-N |