methyl 2-{2-[5-(propan-2-yl)-1-benzofuran-3-yl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[5-(propan-2-yl)-1-benzofuran-3-yl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{2-[5-(propan-2-yl)-1-benzofuran-3-yl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | D038-0970 |
| Compound Name: | methyl 2-{2-[5-(propan-2-yl)-1-benzofuran-3-yl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C23 H25 N O4 S |
| Smiles: | [H]N(C(Cc1coc2ccc(cc12)C(C)C)=O)c1c(C(=O)OC)c2CCCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 5.385 |
| logD: | 2.7486 |
| logSw: | -5.6095 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.565 |
| InChI Key: | FNAAHJXIEMZSFS-UHFFFAOYSA-N |