2-({[2-bromo-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-methoxy-4-nitrophenol
Chemical Structure Depiction of
2-({[2-bromo-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-methoxy-4-nitrophenol
2-({[2-bromo-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-methoxy-4-nitrophenol
Compound characteristics
| Compound ID: | 0781-2989 |
| Compound Name: | 2-({[2-bromo-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-methoxy-4-nitrophenol |
| Molecular Weight: | 482.29 |
| Molecular Formula: | C22 H16 Br N3 O5 |
| Smiles: | Cc1ccc2c(c1)nc(c1ccc(c(c1)/N=C/c1cc(cc(c1O)OC)[N+]([O-])=O)[Br])o2 |
| Stereo: | ACHIRAL |
| logP: | 5.3183 |
| logD: | 3.1515 |
| logSw: | -5.2534 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.969 |
| InChI Key: | JHSSKRHASYTEGE-UHFFFAOYSA-N |