methyl 4-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 4-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate
methyl 4-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate
Compound characteristics
| Compound ID: | C777-1035 |
| Compound Name: | methyl 4-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-4H-thieno[3,2-b]pyrrole-5-carboxylate |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C19 H20 N2 O3 S |
| Smiles: | CCc1cccc(C)c1NC(Cn1c(cc2c1ccs2)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8247 |
| logD: | 3.8247 |
| logSw: | -3.8359 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.638 |
| InChI Key: | FZMQQNJTKYLCAC-UHFFFAOYSA-N |