ethyl 2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4275-1891 |
| Compound Name: | ethyl 2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 353.44 |
| Molecular Formula: | C17 H23 N O5 S |
| Smiles: | CCOC(CCC(Nc1c(C(=O)OCC)c2CCCCc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8994 |
| logD: | 0.5036 |
| logSw: | -3.2149 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.015 |
| InChI Key: | RQVMNXQKDXOJDE-UHFFFAOYSA-N |