3-(4-chlorophenyl)-8-{[cyclohexyl(ethyl)amino]methyl}-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-8-{[cyclohexyl(ethyl)amino]methyl}-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one
3-(4-chlorophenyl)-8-{[cyclohexyl(ethyl)amino]methyl}-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 3931-2300 |
| Compound Name: | 3-(4-chlorophenyl)-8-{[cyclohexyl(ethyl)amino]methyl}-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 479.93 |
| Molecular Formula: | C25 H25 Cl F3 N O3 |
| Smiles: | CCN(Cc1c(ccc2C(C(=C(C(F)(F)F)Oc12)c1ccc(cc1)[Cl])=O)O)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.5231 |
| logD: | 5.5161 |
| logSw: | -5.9641 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.083 |
| InChI Key: | OVHZLCNZAYAVFH-UHFFFAOYSA-N |