ethyl 6-cyano-2-(3,4-difluorobenzamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-cyano-2-(3,4-difluorobenzamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-cyano-2-(3,4-difluorobenzamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V013-5932 |
| Compound Name: | ethyl 6-cyano-2-(3,4-difluorobenzamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 466.51 |
| Molecular Formula: | C25 H20 F2 N2 O3 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(c1ccc(c(c1)F)F)=O)(C#N)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3982 |
| logD: | -0.0539 |
| logSw: | -5.4861 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.583 |
| InChI Key: | YGACXHPSDWPBKK-RUZDIDTESA-N |