ethyl 2-methyl-1-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-1-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 2-methyl-1-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1999 |
| Compound Name: | ethyl 2-methyl-1-{3-oxo-3-[4-(propan-2-yl)anilino]propyl}-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C26 H30 N2 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CCC(Nc2ccc(cc2)C(C)C)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2107 |
| logD: | 6.2106 |
| logSw: | -5.4871 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.799 |
| InChI Key: | MFWMCOJAEHDWJB-UHFFFAOYSA-N |