2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]quinoline-4-carboxamide
2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | F612-0230 |
| Compound Name: | 2-[1-(4-ethylphenyl)-5-methyl-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]quinoline-4-carboxamide |
| Molecular Weight: | 478.62 |
| Molecular Formula: | C29 H26 N4 O S |
| Smiles: | CCc1ccc(cc1)n1c(C)c(cn1)c1cc(C(Nc2cccc(c2)SC)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.1441 |
| logD: | 7.1441 |
| logSw: | -5.6905 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.454 |
| InChI Key: | RCRMFGAWFYERJL-UHFFFAOYSA-N |