ethyl 1-[4-(2-chloroanilino)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-(2-chloroanilino)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
ethyl 1-[4-(2-chloroanilino)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-3191 |
| Compound Name: | ethyl 1-[4-(2-chloroanilino)-4-oxobutyl]-5-(4-methylphenyl)-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 424.93 |
| Molecular Formula: | C24 H25 Cl N2 O3 |
| Smiles: | CCOC(c1cc(c2ccc(C)cc2)n(CCCC(Nc2ccccc2[Cl])=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9152 |
| logD: | 4.913 |
| logSw: | -5.0296 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.633 |
| InChI Key: | GLCFEPPBJMWMPE-UHFFFAOYSA-N |