ethyl 3~4~-bromo-2~5~-oxo-2~2~,2~3~,2~4~,2~5~-tetrahydro[1~1~,2~1~:2~3~,3~1~-terphenyl]-2~4~-carboxylate
Chemical Structure Depiction of
ethyl 3~4~-bromo-2~5~-oxo-2~2~,2~3~,2~4~,2~5~-tetrahydro[1~1~,2~1~:2~3~,3~1~-terphenyl]-2~4~-carboxylate
ethyl 3~4~-bromo-2~5~-oxo-2~2~,2~3~,2~4~,2~5~-tetrahydro[1~1~,2~1~:2~3~,3~1~-terphenyl]-2~4~-carboxylate
Compound characteristics
Compound ID: | 8013-0413 |
Compound Name: | ethyl 3~4~-bromo-2~5~-oxo-2~2~,2~3~,2~4~,2~5~-tetrahydro[1~1~,2~1~:2~3~,3~1~-terphenyl]-2~4~-carboxylate |
Molecular Weight: | 399.28 |
Molecular Formula: | C21 H19 Br O3 |
Smiles: | CCOC(C1C(CC(=CC1=O)c1ccccc1)c1ccc(cc1)[Br])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.1366 |
logD: | 5.1362 |
logSw: | -5.0574 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 33.889 |
InChI Key: | MRWBTWFATINAKT-UHFFFAOYSA-N |