methyl 3-ethoxy-5-{[3-(methylsulfanyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-ethoxy-5-{[3-(methylsulfanyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate
methyl 3-ethoxy-5-{[3-(methylsulfanyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | L311-0069 |
| Compound Name: | methyl 3-ethoxy-5-{[3-(methylsulfanyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C20 H20 N2 O4 S2 |
| Smiles: | CCOc1c2cc(ccc2sc1C(=O)OC)NC(Nc1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4784 |
| logD: | 5.4784 |
| logSw: | -5.5786 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.759 |
| InChI Key: | BVGHAMHACMYNIE-UHFFFAOYSA-N |