1-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
1-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
1-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | J078-1151 |
| Compound Name: | 1-{2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl}-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 437.8 |
| Molecular Formula: | C20 H15 Cl F3 N3 O3 |
| Smiles: | CNC(C1=CC(N(CC(Nc2cc(ccc2[Cl])C(F)(F)F)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6542 |
| logD: | 2.6201 |
| logSw: | -3.7022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.906 |
| InChI Key: | SPTVJOWECOKXKR-UHFFFAOYSA-N |