butan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
butan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
butan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | 5976-1646 |
| Compound Name: | butan-2-yl {[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 454.83 |
| Molecular Formula: | C22 H18 Cl F3 O5 |
| Smiles: | CCC(C)OC(COc1ccc2C(C(=C(C(F)(F)F)Oc2c1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4478 |
| logD: | 5.4478 |
| logSw: | -5.9136 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.498 |
| InChI Key: | NGJDNPAIBUPEAU-LBPRGKRZSA-N |