5-(4-bromoanilino)-3',4'-dimethoxy-1,6-dihydro[1,1'-biphenyl]-3(2H)-one
Chemical Structure Depiction of
5-(4-bromoanilino)-3',4'-dimethoxy-1,6-dihydro[1,1'-biphenyl]-3(2H)-one
5-(4-bromoanilino)-3',4'-dimethoxy-1,6-dihydro[1,1'-biphenyl]-3(2H)-one
Compound characteristics
| Compound ID: | 4038-0113F |
| Compound Name: | 5-(4-bromoanilino)-3',4'-dimethoxy-1,6-dihydro[1,1'-biphenyl]-3(2H)-one |
| Molecular Weight: | 402.29 |
| Molecular Formula: | C20 H20 Br N O3 |
| Smiles: | COc1ccc(cc1OC)C1CC(=CC(C1)=O)Nc1ccc(cc1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5025 |
| logD: | 4.2194 |
| logSw: | -4.4512 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.255 |
| InChI Key: | KZTFQHFSVAAXFD-AWEZNQCLSA-N |