N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitrobenzamide
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 4402-0767 |
| Compound Name: | N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitrobenzamide |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C21 H15 N3 O5 |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(cc1)c1nc2ccccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.06 |
| logD: | 4.0598 |
| logSw: | -4.3182 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.851 |
| InChI Key: | JKWAXXSBODOGOQ-UHFFFAOYSA-N |