N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromo-3-nitrophenyl)methanimine
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromo-3-nitrophenyl)methanimine
N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromo-3-nitrophenyl)methanimine
Compound characteristics
Compound ID: | 8005-6102 |
Compound Name: | N-[4-(1,3-benzothiazol-2-yl)phenyl]-1-(4-bromo-3-nitrophenyl)methanimine |
Molecular Weight: | 438.3 |
Molecular Formula: | C20 H12 Br N3 O2 S |
Smiles: | C(\c1ccc(c(c1)[N+]([O-])=O)[Br])=N/c1ccc(cc1)c1nc2ccccc2s1 |
Stereo: | ACHIRAL |
logP: | 5.887 |
logD: | 5.887 |
logSw: | -6.1931 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 50.895 |
InChI Key: | KFTVIZFZZSEQNU-UHFFFAOYSA-N |