methyl 4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-4H-thieno[3,2-b]pyrrole-5-carboxylate
Chemical Structure Depiction of
methyl 4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-4H-thieno[3,2-b]pyrrole-5-carboxylate
methyl 4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-4H-thieno[3,2-b]pyrrole-5-carboxylate
Compound characteristics
| Compound ID: | C790-0025 |
| Compound Name: | methyl 4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-4H-thieno[3,2-b]pyrrole-5-carboxylate |
| Molecular Weight: | 386.42 |
| Molecular Formula: | C19 H18 N2 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(Cn1c(cc2c1ccs2)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7574 |
| logD: | 3.7572 |
| logSw: | -4.0641 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.788 |
| InChI Key: | JJUHBAXQQUTMJH-UHFFFAOYSA-N |