N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 1140-0032 |
| Compound Name: | N-[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide |
| Molecular Weight: | 485.24 |
| Molecular Formula: | C20 H12 I N3 O4 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)C(Nc1ccc2c(c1)nc(c1cccc(c1)I)o2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5236 |
| logD: | 5.5072 |
| logSw: | -5.8311 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | JPPUWMSXSRSVAE-UHFFFAOYSA-N |