ethyl 2-methyl-5-(4-methylphenyl)-1-{3-oxo-3-[4-(trifluoromethyl)anilino]propyl}-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-5-(4-methylphenyl)-1-{3-oxo-3-[4-(trifluoromethyl)anilino]propyl}-1H-pyrrole-3-carboxylate
ethyl 2-methyl-5-(4-methylphenyl)-1-{3-oxo-3-[4-(trifluoromethyl)anilino]propyl}-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | C721-0745 |
| Compound Name: | ethyl 2-methyl-5-(4-methylphenyl)-1-{3-oxo-3-[4-(trifluoromethyl)anilino]propyl}-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 458.48 |
| Molecular Formula: | C25 H25 F3 N2 O3 |
| Smiles: | CCOC(c1cc(c2ccc(C)cc2)n(CCC(Nc2ccc(cc2)C(F)(F)F)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2737 |
| logD: | 6.2736 |
| logSw: | -5.4959 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.799 |
| InChI Key: | KLUIPRQKTJXMPY-UHFFFAOYSA-N |