ethyl 6-methyl-2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-methyl-2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-methyl-2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2712-4351 |
| Compound Name: | ethyl 6-methyl-2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 485.69 |
| Molecular Formula: | C28 H39 N O4 S |
| Smiles: | CCOC(c1c2CCC(C)Cc2sc1NC(COc1ccc(cc1)C(C)(C)CC(C)(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.7194 |
| logD: | 5.5375 |
| logSw: | -5.8887 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.084 |
| InChI Key: | XLDRPYPDZMCSDU-GOSISDBHSA-N |