6-methyl-2-[5-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
Chemical Structure Depiction of
6-methyl-2-[5-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
6-methyl-2-[5-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | F612-1053 |
| Compound Name: | 6-methyl-2-[5-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}quinoline-4-carboxamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C30 H28 N4 O S |
| Smiles: | Cc1ccc(cc1)n1c(C)c(cn1)c1cc(C(NCc2ccc(cc2)SC)=O)c2cc(C)ccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.4607 |
| logD: | 7.4607 |
| logSw: | -5.5167 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.776 |
| InChI Key: | PNEAACKPBBYXEG-UHFFFAOYSA-N |