methyl 2-{2-[3-(trifluoromethyl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[3-(trifluoromethyl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-{2-[3-(trifluoromethyl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8011-9346 |
| Compound Name: | methyl 2-{2-[3-(trifluoromethyl)phenoxy]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 413.41 |
| Molecular Formula: | C19 H18 F3 N O4 S |
| Smiles: | COC(c1c2CCCCc2sc1NC(COc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5877 |
| logD: | 2.4059 |
| logSw: | -4.6256 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.504 |
| InChI Key: | HVNXKZUZYGGMOB-UHFFFAOYSA-N |