2-bromo-6-({[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol
Chemical Structure Depiction of
2-bromo-6-({[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol
2-bromo-6-({[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol
Compound characteristics
| Compound ID: | 1315-0403 |
| Compound Name: | 2-bromo-6-({[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-nitrophenol |
| Molecular Weight: | 452.26 |
| Molecular Formula: | C21 H14 Br N3 O4 |
| Smiles: | Cc1ccc2c(c1)nc(c1ccc(cc1)/N=C\c1cc(cc(c1O)[Br])[N+]([O-])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.773 |
| logD: | 2.6887 |
| logSw: | -5.4011 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.037 |
| InChI Key: | NVVSLNPGLSHKPS-UHFFFAOYSA-N |