N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-chloro-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-chloro-3-nitrobenzamide
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-chloro-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2783-5033 |
| Compound Name: | N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-chloro-3-nitrobenzamide |
| Molecular Weight: | 393.78 |
| Molecular Formula: | C20 H12 Cl N3 O4 |
| Smiles: | c1ccc2c(c1)nc(c1ccc(cc1)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 4.7764 |
| logD: | 4.7735 |
| logSw: | -5.1422 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.22 |
| InChI Key: | AWBMGMXWODBWEK-UHFFFAOYSA-N |