8-[(diethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Chemical Structure Depiction of
8-[(diethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one
8-[(diethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 5848-4123 |
| Compound Name: | 8-[(diethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one |
| Molecular Weight: | 435.44 |
| Molecular Formula: | C23 H24 F3 N O4 |
| Smiles: | CCc1ccc(cc1)OC1=C(C(F)(F)F)Oc2c(ccc(c2CN(CC)CC)O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.5201 |
| logD: | 4.4743 |
| logSw: | -5.1732 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.28 |
| InChI Key: | MDWVXZPARGVMMJ-UHFFFAOYSA-N |