methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Compound characteristics
| Compound ID: | C777-0896 |
| Compound Name: | methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C20 H22 N2 O5 S |
| Smiles: | CCc1cc2c(cc(C(=O)OC)n2CC(Nc2cc(cc(c2)OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2062 |
| logD: | 4.2058 |
| logSw: | -4.1569 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.122 |
| InChI Key: | MEZFKBHATMIGIV-UHFFFAOYSA-N |