ethyl 2-{2-[3-methyl-4-(propan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[3-methyl-4-(propan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{2-[3-methyl-4-(propan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3931-1250 |
| Compound Name: | ethyl 2-{2-[3-methyl-4-(propan-2-yl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C23 H29 N O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(COc1ccc(C(C)C)c(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7738 |
| logD: | 3.5919 |
| logSw: | -5.5007 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.084 |
| InChI Key: | HQNQFUBYUDXRMC-UHFFFAOYSA-N |