methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[3-(trifluoromethyl)benzamido]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[3-(trifluoromethyl)benzamido]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[3-(trifluoromethyl)benzamido]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8010-7331 |
| Compound Name: | methyl 2-({3-ethoxy-1,1,1-trifluoro-3-oxo-2-[3-(trifluoromethyl)benzamido]propan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 552.49 |
| Molecular Formula: | C23 H22 F6 N2 O5 S |
| Smiles: | CCOC(C(C(F)(F)F)(NC(c1cccc(c1)C(F)(F)F)=O)Nc1c(C(=O)OC)c2CCCCc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6873 |
| logD: | 3.9246 |
| logSw: | -5.5279 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.169 |
| InChI Key: | VQXFUGZNJNMGEL-OAQYLSRUSA-N |