3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate
Chemical Structure Depiction of
3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate
3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate
Compound characteristics
Compound ID: | 4300-0449 |
Compound Name: | 3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate |
Molecular Weight: | 434.75 |
Molecular Formula: | C21 H10 Cl F3 O5 |
Smiles: | c1ccc(c(c1)C1=C(C(F)(F)F)Oc2cc(ccc2C1=O)OC(c1ccco1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.8091 |
logD: | 4.8091 |
logSw: | -5.067 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 49.234 |
InChI Key: | CNVUPTMAMYTSKJ-UHFFFAOYSA-N |