N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-nitrobenzamide
N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1550-1003 |
| Compound Name: | N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-nitrobenzamide |
| Molecular Weight: | 393.78 |
| Molecular Formula: | C20 H12 Cl N3 O4 |
| Smiles: | c1cc(cc(c1)NC(c1ccc(cc1)[N+]([O-])=O)=O)c1nc2cc(ccc2o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.143 |
| logD: | 5.143 |
| logSw: | -5.7951 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | SHBBPAVZNIKWEA-UHFFFAOYSA-N |