ethyl 2-acetamido-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-acetamido-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-acetamido-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V006-0220 |
| Compound Name: | ethyl 2-acetamido-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 337.48 |
| Molecular Formula: | C18 H27 N O3 S |
| Smiles: | CCC(C)(C)C1CCc2c(C(=O)OCC)c(NC(C)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9541 |
| logD: | 2.0746 |
| logSw: | -4.0718 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.969 |
| InChI Key: | BYQCPTMDUKNJEO-GFCCVEGCSA-N |