2-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
Chemical Structure Depiction of
2-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
2-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | F612-0466 |
| Compound Name: | 2-[1-(4-fluorophenyl)-5-methyl-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide |
| Molecular Weight: | 482.58 |
| Molecular Formula: | C28 H23 F N4 O S |
| Smiles: | Cc1c(cnn1c1ccc(cc1)F)c1cc(C(NCc2ccc(cc2)SC)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.4646 |
| logD: | 6.4646 |
| logSw: | -5.7181 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.776 |
| InChI Key: | XZVGJVKCOZGLMN-UHFFFAOYSA-N |