N-(1,2-benzoxazol-3-yl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(1,2-benzoxazol-3-yl)-4-nitrobenzamide
N-(1,2-benzoxazol-3-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | D050-0051 |
| Compound Name: | N-(1,2-benzoxazol-3-yl)-4-nitrobenzamide |
| Molecular Weight: | 283.24 |
| Molecular Formula: | C14 H9 N3 O4 |
| Smiles: | c1ccc2c(c1)c(NC(c1ccc(cc1)[N+]([O-])=O)=O)no2 |
| Stereo: | ACHIRAL |
| logP: | 3.0563 |
| logD: | 2.9894 |
| logSw: | -3.5632 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.78 |
| InChI Key: | SMJAHLQKSKTJLC-UHFFFAOYSA-N |