methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate
methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate
Compound characteristics
| Compound ID: | C777-0308 |
| Compound Name: | methyl 4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate |
| Molecular Weight: | 374.41 |
| Molecular Formula: | C18 H18 N2 O5 S |
| Smiles: | COC(c1cc2c(ccs2)n1CC(Nc1cc(cc(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2951 |
| logD: | 3.2947 |
| logSw: | -3.5562 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.122 |
| InChI Key: | KHSXKWIWMIQBCC-UHFFFAOYSA-N |