diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-1H-pyrrole-3,4-dicarboxylate
Chemical Structure Depiction of
diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-1H-pyrrole-3,4-dicarboxylate
diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-1H-pyrrole-3,4-dicarboxylate
Compound characteristics
| Compound ID: | K815-0019 |
| Compound Name: | diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-1H-pyrrole-3,4-dicarboxylate |
| Molecular Weight: | 403.47 |
| Molecular Formula: | C22 H29 N O6 |
| Smiles: | CCOC(c1c(C(=O)OCC)c(C)n(CCc2ccc(c(c2)OC)OC)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2273 |
| logD: | 3.2273 |
| logSw: | -3.2824 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.682 |
| InChI Key: | NTLXIDRRWPVIOR-UHFFFAOYSA-N |