propan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
propan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
propan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 3793-3501 |
| Compound Name: | propan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 440.8 |
| Molecular Formula: | C21 H16 Cl F3 O5 |
| Smiles: | CC(C)OC(COc1ccc2C(C(=C(C(F)(F)F)Oc2c1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8296 |
| logD: | 4.8296 |
| logSw: | -4.8657 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.615 |
| InChI Key: | YMJSCBUHHFCDBN-UHFFFAOYSA-N |