N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-2-chloro-5-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-2-chloro-5-nitrobenzamide
N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-2-chloro-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2154-0448 |
| Compound Name: | N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-2-chloro-5-nitrobenzamide |
| Molecular Weight: | 472.68 |
| Molecular Formula: | C20 H11 Br Cl N3 O4 |
| Smiles: | c1cc(ccc1c1nc2cc(ccc2o1)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.8526 |
| logD: | 5.7273 |
| logSw: | -6.071 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | ZDRAPAPQJVPWPR-UHFFFAOYSA-N |