4-nitro-N-{4-[5-(4-nitrobenzamido)-1,3-benzoxazol-2-yl]phenyl}benzamide
Chemical Structure Depiction of
4-nitro-N-{4-[5-(4-nitrobenzamido)-1,3-benzoxazol-2-yl]phenyl}benzamide
4-nitro-N-{4-[5-(4-nitrobenzamido)-1,3-benzoxazol-2-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | 0478-0717 |
| Compound Name: | 4-nitro-N-{4-[5-(4-nitrobenzamido)-1,3-benzoxazol-2-yl]phenyl}benzamide |
| Molecular Weight: | 523.46 |
| Molecular Formula: | C27 H17 N5 O7 |
| Smiles: | c1cc(ccc1C(Nc1ccc(cc1)c1nc2cc(ccc2o1)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2289 |
| logD: | 5.2271 |
| logSw: | -5.4838 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 129.994 |
| InChI Key: | ACZQBUISXCTDTR-UHFFFAOYSA-N |