ethyl 5-(2-cyanoanilino)-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
Chemical Structure Depiction of
ethyl 5-(2-cyanoanilino)-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
ethyl 5-(2-cyanoanilino)-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
Compound characteristics
| Compound ID: | 8014-9747 |
| Compound Name: | ethyl 5-(2-cyanoanilino)-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C23 H22 N2 O4 |
| Smiles: | CCOC(C1C(CC(=CC1=O)Nc1ccccc1C#N)c1cccc(c1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7435 |
| logD: | 3.0112 |
| logSw: | -4.0548 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.549 |
| InChI Key: | ODOVRRLXVHBQDS-UHFFFAOYSA-N |