N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-(4-nitrophenoxy)acetamide
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-(4-nitrophenoxy)acetamide
Compound characteristics
| Compound ID: | 7833-0628 |
| Compound Name: | N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-(4-nitrophenoxy)acetamide |
| Molecular Weight: | 417.42 |
| Molecular Formula: | C23 H19 N3 O5 |
| Smiles: | Cc1cc(C)c2c(c1)nc(c1cccc(c1)NC(COc1ccc(cc1)[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.4468 |
| logD: | 5.4468 |
| logSw: | -5.4195 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.04 |
| InChI Key: | YCDSQLKASSDXKN-UHFFFAOYSA-N |