7-(3-ethoxy-4-hydroxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Chemical Structure Depiction of
7-(3-ethoxy-4-hydroxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
7-(3-ethoxy-4-hydroxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | 8020-3439 |
| Compound Name: | 7-(3-ethoxy-4-hydroxyphenyl)-5-oxo-1-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid |
| Molecular Weight: | 460.41 |
| Molecular Formula: | C23 H19 F3 N2 O5 |
| Smiles: | CCOc1cc(ccc1O)C1CC(Nc2c(cn(c3cccc(c3)C(F)(F)F)c12)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9598 |
| logD: | 0.1726 |
| logSw: | -3.5963 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.031 |
| InChI Key: | IIVZSDMLFHLYIK-OAHLLOKOSA-N |