2-({[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol
Chemical Structure Depiction of
2-({[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol
2-({[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol
Compound characteristics
| Compound ID: | 0957-0238 |
| Compound Name: | 2-({[4-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C21 H15 N3 O5 |
| Smiles: | COc1ccc2c(c1)nc(c1ccc(cc1)/N=C/c1cc(ccc1O)[N+]([O-])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 4.5261 |
| logD: | 2.6747 |
| logSw: | -4.2398 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.649 |
| InChI Key: | QFEUCYYPKRQLRH-UHFFFAOYSA-N |