N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K219-0874 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 397.74 |
| Molecular Formula: | C18 H11 Cl F3 N O4 |
| Smiles: | COc1ccc2c(C=C(C(Nc3cc(ccc3[Cl])C(F)(F)F)=O)C(=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3055 |
| logD: | 2.5102 |
| logSw: | -4.623 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.097 |
| InChI Key: | MHOXJCHXICLZGZ-UHFFFAOYSA-N |