ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethoxy-4-oxobutanamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethoxy-4-oxobutanamido)thiophene-3-carboxylate
ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethoxy-4-oxobutanamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | V001-7360 |
| Compound Name: | ethyl 5-(4,4-dimethylpentan-2-yl)-2-(4-ethoxy-4-oxobutanamido)thiophene-3-carboxylate |
| Molecular Weight: | 397.53 |
| Molecular Formula: | C20 H31 N O5 S |
| Smiles: | CCOC(CCC(Nc1c(cc(C(C)CC(C)(C)C)s1)C(=O)OCC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4703 |
| logD: | 3.1322 |
| logSw: | -4.247 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.094 |
| InChI Key: | PLPWPRCLHNAGGJ-ZDUSSCGKSA-N |