3-(2-chlorophenyl)-7-hydroxy-8-[(piperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(2-chlorophenyl)-7-hydroxy-8-[(piperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
3-(2-chlorophenyl)-7-hydroxy-8-[(piperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
Compound ID: | 3232-1889 |
Compound Name: | 3-(2-chlorophenyl)-7-hydroxy-8-[(piperidin-1-yl)methyl]-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
Molecular Weight: | 437.84 |
Molecular Formula: | C22 H19 Cl F3 N O3 |
Smiles: | C1CCN(CC1)Cc1c(ccc2C(C(=C(C(F)(F)F)Oc12)c1ccccc1[Cl])=O)O |
Stereo: | ACHIRAL |
logP: | 5.1086 |
logD: | 4.1749 |
logSw: | -4.9528 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.243 |
InChI Key: | PZCDEBPCTKJHHP-UHFFFAOYSA-N |