4-{[(4-bromo-3-nitrophenyl)methylidene]amino}-2-(6-methyl-1,3-benzoxazol-2-yl)phenol
Chemical Structure Depiction of
4-{[(4-bromo-3-nitrophenyl)methylidene]amino}-2-(6-methyl-1,3-benzoxazol-2-yl)phenol
4-{[(4-bromo-3-nitrophenyl)methylidene]amino}-2-(6-methyl-1,3-benzoxazol-2-yl)phenol
Compound characteristics
| Compound ID: | 8005-6110 |
| Compound Name: | 4-{[(4-bromo-3-nitrophenyl)methylidene]amino}-2-(6-methyl-1,3-benzoxazol-2-yl)phenol |
| Molecular Weight: | 452.26 |
| Molecular Formula: | C21 H14 Br N3 O4 |
| Smiles: | Cc1ccc2c(c1)oc(c1cc(ccc1O)/N=C/c1ccc(c(c1)[N+]([O-])=O)[Br])n2 |
| Stereo: | ACHIRAL |
| logP: | 5.9463 |
| logD: | 5.9448 |
| logSw: | -5.4941 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.805 |
| InChI Key: | BATLQHXCIBYIPW-UHFFFAOYSA-N |