2-bromo-N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide
Chemical Structure Depiction of
2-bromo-N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide
2-bromo-N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2072-0770 |
| Compound Name: | 2-bromo-N-[4-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide |
| Molecular Weight: | 472.68 |
| Molecular Formula: | C20 H11 Br Cl N3 O4 |
| Smiles: | c1cc(ccc1c1nc2cc(ccc2o1)[Cl])NC(c1cc(ccc1[Br])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4211 |
| logD: | 5.4182 |
| logSw: | -6.0225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | XURLXROFFVVBSX-UHFFFAOYSA-N |