ethyl 1-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-2265 |
| Compound Name: | ethyl 1-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C25 H28 N2 O5 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CCC(Nc2ccc(c(c2)OC)OC)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4074 |
| logD: | 4.4072 |
| logSw: | -4.1945 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.06 |
| InChI Key: | GWUNGWZEEYGQAR-UHFFFAOYSA-N |