3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl thiophene-2-carboxylate
Chemical Structure Depiction of
3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl thiophene-2-carboxylate
3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 4300-0450 |
| Compound Name: | 3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl thiophene-2-carboxylate |
| Molecular Weight: | 450.82 |
| Molecular Formula: | C21 H10 Cl F3 O4 S |
| Smiles: | c1ccc(c(c1)C1=C(C(F)(F)F)Oc2cc(ccc2C1=O)OC(c1cccs1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6378 |
| logD: | 5.6378 |
| logSw: | -6.0264 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.674 |
| InChI Key: | FKBCBZZXFOGQEF-UHFFFAOYSA-N |