1-[(4-fluorophenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(thiophen-2-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-[(4-fluorophenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(thiophen-2-yl)-1H-pyrazole-5-carboxamide
1-[(4-fluorophenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(thiophen-2-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | C796-1068 |
| Compound Name: | 1-[(4-fluorophenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-3-(thiophen-2-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C23 H20 F N3 O S2 |
| Smiles: | CSc1ccc(CNC(c2cc(c3cccs3)nn2Cc2ccc(cc2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2513 |
| logD: | 5.2513 |
| logSw: | -5.0987 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.357 |
| InChI Key: | ZTRUIGMMMRRJBB-UHFFFAOYSA-N |