6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione
Chemical Structure Depiction of
6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione
6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione
Compound characteristics
Compound ID: | F542-0831 |
Compound Name: | 6-{5-[(4-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl}-1-(2-methylpropyl)-1,4-dihydroquinoxaline-2,3-dione |
Molecular Weight: | 455.31 |
Molecular Formula: | C21 H19 Br N4 O3 |
Smiles: | CC(C)CN1C(C(Nc2cc(ccc12)c1nc(Cc2ccc(cc2)[Br])on1)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.2966 |
logD: | 5.2776 |
logSw: | -5.268 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.641 |
InChI Key: | SUZFZOVNHMFHIV-UHFFFAOYSA-N |