methyl 6-methyl-4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,4-dihydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 6-methyl-4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,4-dihydroquinoline-3-carboxylate
methyl 6-methyl-4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,4-dihydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | G023-1311 |
| Compound Name: | methyl 6-methyl-4-oxo-2-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-1,4-dihydroquinoline-3-carboxylate |
| Molecular Weight: | 450.43 |
| Molecular Formula: | C21 H17 F3 N2 O4 S |
| Smiles: | Cc1ccc2c(c1)C(C(=C(N2)SCC(Nc1ccccc1C(F)(F)F)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1686 |
| logD: | 2.6883 |
| logSw: | -4.3158 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.166 |
| InChI Key: | JAGINDUBOGPRDG-UHFFFAOYSA-N |