ethyl 6-cyano-2-(2-phenoxypropanamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-cyano-2-(2-phenoxypropanamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-cyano-2-(2-phenoxypropanamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V011-0838 |
| Compound Name: | ethyl 6-cyano-2-(2-phenoxypropanamido)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C27 H26 N2 O4 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(C(C)Oc1ccccc1)=O)(C#N)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3195 |
| logD: | 2.9073 |
| logSw: | -5.382 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.372 |
| InChI Key: | XDSGKQUHCXTEGV-UHFFFAOYSA-N |