methyl 3-ethoxy-5-{[2-(trifluoromethyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-ethoxy-5-{[2-(trifluoromethyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate
methyl 3-ethoxy-5-{[2-(trifluoromethyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | L311-0039 |
| Compound Name: | methyl 3-ethoxy-5-{[2-(trifluoromethyl)phenyl]carbamamido}-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 438.42 |
| Molecular Formula: | C20 H17 F3 N2 O4 S |
| Smiles: | CCOc1c2cc(ccc2sc1C(=O)OC)NC(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.534 |
| logD: | 5.534 |
| logSw: | -5.6013 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.061 |
| InChI Key: | CJKOOUQGLYMTSM-UHFFFAOYSA-N |