ethyl 6-cyano-2-[2-methoxy(oxo)acetamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-cyano-2-[2-methoxy(oxo)acetamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-cyano-2-[2-methoxy(oxo)acetamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V011-2430 |
| Compound Name: | ethyl 6-cyano-2-[2-methoxy(oxo)acetamido]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 412.46 |
| Molecular Formula: | C21 H20 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(C(=O)OC)=O)(C#N)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3867 |
| logD: | -2.5281 |
| logSw: | -3.8603 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.028 |
| InChI Key: | ULJQESQILKOCDL-OAQYLSRUSA-N |