ethyl 5-[(5-bromopyridin-2-yl)amino]-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
Chemical Structure Depiction of
ethyl 5-[(5-bromopyridin-2-yl)amino]-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
ethyl 5-[(5-bromopyridin-2-yl)amino]-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate
Compound characteristics
| Compound ID: | 8014-9726 |
| Compound Name: | ethyl 5-[(5-bromopyridin-2-yl)amino]-3'-methoxy-3-oxo-1,2,3,6-tetrahydro[1,1'-biphenyl]-2-carboxylate |
| Molecular Weight: | 445.31 |
| Molecular Formula: | C21 H21 Br N2 O4 |
| Smiles: | CCOC(C1C(CC(=CC1=O)Nc1ccc(cn1)[Br])c1cccc(c1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5221 |
| logD: | 2.8994 |
| logSw: | -4.2906 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.895 |
| InChI Key: | XIPYCTKLEHZMCO-UHFFFAOYSA-N |