5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[3-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[3-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[3-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3226-0416 |
| Compound Name: | 5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[3-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 436.35 |
| Molecular Formula: | C23 H11 F3 N2 O4 |
| Smiles: | c1ccc2c(c1)C(=O)OC(c1ccc3C(N(C(c3c1)=O)c1cccc(c1)C(F)(F)F)=O)=N2 |
| Stereo: | ACHIRAL |
| logP: | 4.3132 |
| logD: | 4.3132 |
| logSw: | -4.6835 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.827 |
| InChI Key: | NYKQHZDROVKORA-UHFFFAOYSA-N |