2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0284 |
| Compound Name: | 2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 346.38 |
| Molecular Formula: | C18 H22 N2 O5 |
| Smiles: | CCn1cc(C)c(C(O)=O)c1CC(Nc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7528 |
| logD: | -0.0464 |
| logSw: | -2.2165 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.521 |
| InChI Key: | FXBYRKAWPJAIHW-UHFFFAOYSA-N |