4-benzyl-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
Chemical Structure Depiction of
4-benzyl-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
4-benzyl-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
Compound characteristics
Compound ID: | 1812-0671 |
Compound Name: | 4-benzyl-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol |
Molecular Weight: | 483.91 |
Molecular Formula: | C27 H18 Cl N3 O4 |
Smiles: | C(c1ccccc1)c1cc(/C=N/c2cccc(c2)c2nc3cc(ccc3o2)[Cl])c(c(c1)[N+]([O-])=O)O |
Stereo: | ACHIRAL |
logP: | 7.1347 |
logD: | 5.3326 |
logSw: | -6.3355 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.464 |
InChI Key: | FCQVDLYXSPLQDB-UHFFFAOYSA-N |