ethyl 2-methyl-1-[3-oxo-3-(3,4,5-trimethoxyanilino)propyl]-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-1-[3-oxo-3-(3,4,5-trimethoxyanilino)propyl]-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 2-methyl-1-[3-oxo-3-(3,4,5-trimethoxyanilino)propyl]-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-2544 |
| Compound Name: | ethyl 2-methyl-1-[3-oxo-3-(3,4,5-trimethoxyanilino)propyl]-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 466.53 |
| Molecular Formula: | C26 H30 N2 O6 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CCC(Nc2cc(c(c(c2)OC)OC)OC)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.253 |
| logD: | 4.2517 |
| logSw: | -4.1763 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.777 |
| InChI Key: | JFNAVAHSKMYWHT-UHFFFAOYSA-N |