[1,1'-biphenyl]-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
[1,1'-biphenyl]-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
[1,1'-biphenyl]-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 3057-1252 |
| Compound Name: | [1,1'-biphenyl]-2-yl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 421.25 |
| Molecular Formula: | C22 H13 Br O4 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[Br])C(=O)Oc1ccccc1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3188 |
| logD: | 5.3188 |
| logSw: | -5.7867 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.353 |
| InChI Key: | YNGDIDCZBXXNHH-UHFFFAOYSA-N |