ethyl 1-[2-(2-fluoroanilino)-2-oxoethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(2-fluoroanilino)-2-oxoethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-[2-(2-fluoroanilino)-2-oxoethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1525 |
| Compound Name: | ethyl 1-[2-(2-fluoroanilino)-2-oxoethyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 380.42 |
| Molecular Formula: | C22 H21 F N2 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CC(Nc2ccccc2F)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.747 |
| logD: | 4.7467 |
| logSw: | -4.4447 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.123 |
| InChI Key: | CUXXXRIHQHJICQ-UHFFFAOYSA-N |