2-({[2-methoxy-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
Chemical Structure Depiction of
2-({[2-methoxy-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
2-({[2-methoxy-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
Compound characteristics
Compound ID: | 0808-0067 |
Compound Name: | 2-({[2-methoxy-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol |
Molecular Weight: | 403.39 |
Molecular Formula: | C22 H17 N3 O5 |
Smiles: | Cc1ccc2c(c1)nc(c1ccc(c(c1)/N=C/c1cccc(c1O)[N+]([O-])=O)OC)o2 |
Stereo: | ACHIRAL |
logP: | 4.8359 |
logD: | 2.956 |
logSw: | -4.6295 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.669 |
InChI Key: | MWJYAWWWBPCDOW-UHFFFAOYSA-N |