N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide
N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8290-03316 |
| Compound Name: | N-[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide |
| Molecular Weight: | 373.37 |
| Molecular Formula: | C21 H15 N3 O4 |
| Smiles: | Cc1ccc2c(c1)oc(c1cccc(c1)NC(c1cccc(c1)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.0156 |
| logD: | 5.0154 |
| logSw: | -4.7623 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | IOANPOPVUXOEOP-UHFFFAOYSA-N |