2-[(4'-methoxy-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl)amino]benzonitrile
Chemical Structure Depiction of
2-[(4'-methoxy-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl)amino]benzonitrile
2-[(4'-methoxy-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl)amino]benzonitrile
Compound characteristics
| Compound ID: | 8015-3029 |
| Compound Name: | 2-[(4'-methoxy-5-oxo-1,2,5,6-tetrahydro[1,1'-biphenyl]-3-yl)amino]benzonitrile |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C20 H18 N2 O2 |
| Smiles: | COc1ccc(cc1)C1CC(=CC(C1)=O)Nc1ccccc1C#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8311 |
| logD: | 2.8789 |
| logSw: | -4.134 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.896 |
| InChI Key: | PMCVUOZSMMWHIS-INIZCTEOSA-N |