methyl 5-(4-fluoroanilino)-4'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
Chemical Structure Depiction of
methyl 5-(4-fluoroanilino)-4'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
methyl 5-(4-fluoroanilino)-4'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
Compound characteristics
| Compound ID: | 8014-9736 |
| Compound Name: | methyl 5-(4-fluoroanilino)-4'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate |
| Molecular Weight: | 369.39 |
| Molecular Formula: | C21 H20 F N O4 |
| Smiles: | COC(C1C(CC(=CC1=O)Nc1ccc(cc1)F)c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7156 |
| logD: | 3.5373 |
| logSw: | -4.1089 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.61 |
| InChI Key: | PITPOKMPKVZPRG-UHFFFAOYSA-N |