5-oxo-N-(2-oxo-2H-1-benzopyran-6-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
5-oxo-N-(2-oxo-2H-1-benzopyran-6-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
5-oxo-N-(2-oxo-2H-1-benzopyran-6-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | Y042-3211 |
| Compound Name: | 5-oxo-N-(2-oxo-2H-1-benzopyran-6-yl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide |
| Molecular Weight: | 416.35 |
| Molecular Formula: | C21 H15 F3 N2 O4 |
| Smiles: | C1C(CN(C1=O)c1cccc(c1)C(F)(F)F)C(Nc1ccc2c(C=CC(=O)O2)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6464 |
| logD: | 2.6462 |
| logSw: | -3.295 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.487 |
| InChI Key: | VHFGZNUQCIPMBJ-CYBMUJFWSA-N |