5-bromo-3-[(4'-octyl[1,1'-biphenyl]-4-yl)imino]-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-bromo-3-[(4'-octyl[1,1'-biphenyl]-4-yl)imino]-1,3-dihydro-2H-indol-2-one
5-bromo-3-[(4'-octyl[1,1'-biphenyl]-4-yl)imino]-1,3-dihydro-2H-indol-2-one
Compound characteristics
Compound ID: | K014-0003 |
Compound Name: | 5-bromo-3-[(4'-octyl[1,1'-biphenyl]-4-yl)imino]-1,3-dihydro-2H-indol-2-one |
Molecular Weight: | 489.46 |
Molecular Formula: | C28 H29 Br N2 O |
Smiles: | CCCCCCCCc1ccc(cc1)c1ccc(cc1)/N=C1C(Nc2ccc(cc\12)[Br])=O |
Stereo: | ACHIRAL |
logP: | 9.2074 |
logD: | 9.2074 |
logSw: | -5.7092 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 31.946 |
InChI Key: | IPRIFJUXVWEOBK-UHFFFAOYSA-N |