methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Compound characteristics
| Compound ID: | C777-1111 |
| Compound Name: | methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-ethyl-4H-thieno[3,2-b]pyrrole-5-carboxylate |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C21 H22 N2 O5 S |
| Smiles: | CCc1cc2c(cc(C(=O)OC)n2CC(Nc2ccccc2C(=O)OCC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3353 |
| logD: | 4.3028 |
| logSw: | -4.2618 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.09 |
| InChI Key: | MLTUHMAHPIRELD-UHFFFAOYSA-N |