ethyl 1-[3-(2,5-diethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(2,5-diethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-[3-(2,5-diethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-2182 |
| Compound Name: | ethyl 1-[3-(2,5-diethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 464.56 |
| Molecular Formula: | C27 H32 N2 O5 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CCC(Nc2cc(ccc2OCC)OCC)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3649 |
| logD: | 5.363 |
| logSw: | -5.3728 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.435 |
| InChI Key: | YXGCISBYSFWYAW-UHFFFAOYSA-N |