ethyl 2-[2-({1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}sulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-({1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}sulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-({1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}sulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | K413-0080 |
| Compound Name: | ethyl 2-[2-({1-[(3-fluorophenyl)methyl]-1H-indol-3-yl}sulfanyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 522.66 |
| Molecular Formula: | C28 H27 F N2 O3 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CSc1cn(Cc2cccc(c2)F)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1799 |
| logD: | 3.998 |
| logSw: | -5.5553 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.317 |
| InChI Key: | AVYMRQGQGGUKAI-UHFFFAOYSA-N |