methyl 3-ethoxy-5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-ethoxy-5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-benzothiophene-2-carboxylate
methyl 3-ethoxy-5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | L312-0132 |
| Compound Name: | methyl 3-ethoxy-5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 433.52 |
| Molecular Formula: | C21 H20 F N O4 S2 |
| Smiles: | CCOc1c2cc(ccc2sc1C(=O)OC)NC(CSCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9958 |
| logD: | 4.9957 |
| logSw: | -4.7575 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.334 |
| InChI Key: | VXYZRLGYDVEHDY-UHFFFAOYSA-N |