methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
Compound characteristics
| Compound ID: | C794-1092 |
| Compound Name: | methyl 4-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate |
| Molecular Weight: | 400.45 |
| Molecular Formula: | C20 H20 N2 O5 S |
| Smiles: | CCOC(c1ccccc1NC(Cn1c(cc2c1cc(C)s2)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0145 |
| logD: | 3.9819 |
| logSw: | -4.1639 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.09 |
| InChI Key: | DBQPQSBDOKJXNV-UHFFFAOYSA-N |