methyl 2-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | D038-0634 |
| Compound Name: | methyl 2-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C22 H23 N O4 S |
| Smiles: | [H]N(C(Cc1coc2cc(C)cc(C)c12)=O)c1c(C(=O)OC)c2CCCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.9924 |
| logD: | 2.356 |
| logSw: | -4.9313 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.565 |
| InChI Key: | CWMFBFCDKKYGSW-UHFFFAOYSA-N |