ethyl 6-tert-butyl-2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-tert-butyl-2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-tert-butyl-2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V007-1946 |
| Compound Name: | ethyl 6-tert-butyl-2-(4-ethoxy-4-oxobutanamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 409.54 |
| Molecular Formula: | C21 H31 N O5 S |
| Smiles: | CCOC(CCC(Nc1c(C(=O)OCC)c2CCC(Cc2s1)C(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4567 |
| logD: | 2.0608 |
| logSw: | -4.2708 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.015 |
| InChI Key: | KYJHZYOMLNLRGC-CYBMUJFWSA-N |