1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | E751-4224 |
| Compound Name: | 1-(4-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 392.45 |
| Molecular Formula: | C21 H17 F N4 O S |
| Smiles: | CSc1cccc(c1)NC(c1cnn(c2ccc(cc2)F)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1002 |
| logD: | 5.1002 |
| logSw: | -4.7493 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.186 |
| InChI Key: | XILYNBQZQDZTAY-UHFFFAOYSA-N |