ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V008-3018 |
| Compound Name: | ethyl 2-[2-(acetyloxy)-2-methylpropanamido]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 423.57 |
| Molecular Formula: | C22 H33 N O5 S |
| Smiles: | CCC(C)(C)C1CCc2c(C(=O)OCC)c(NC(C(C)(C)OC(C)=O)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.404 |
| logD: | 1.803 |
| logSw: | -4.272 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.021 |
| InChI Key: | AYVBIRSLAZKVQK-CQSZACIVSA-N |