ethyl 2-methyl-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 2-methyl-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1519 |
| Compound Name: | ethyl 2-methyl-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 430.43 |
| Molecular Formula: | C23 H21 F3 N2 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CC(Nc2cccc(c2)C(F)(F)F)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0101 |
| logD: | 6.009 |
| logSw: | -5.6005 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.821 |
| InChI Key: | CCOBMTOGWXEOQB-UHFFFAOYSA-N |