ethyl 1-{2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-{2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1635 |
| Compound Name: | ethyl 1-{2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 464.87 |
| Molecular Formula: | C23 H20 Cl F3 N2 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CC(Nc2ccc(c(c2)C(F)(F)F)[Cl])=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5741 |
| logD: | 6.5085 |
| logSw: | -6.159 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.821 |
| InChI Key: | GAPBYBMYYXYABH-UHFFFAOYSA-N |