N-[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]-2,4-dinitrobenzamide
Chemical Structure Depiction of
N-[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]-2,4-dinitrobenzamide
N-[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]-2,4-dinitrobenzamide
Compound characteristics
| Compound ID: | 1812-0473 |
| Compound Name: | N-[2-(naphthalen-1-yl)-1,3-benzoxazol-5-yl]-2,4-dinitrobenzamide |
| Molecular Weight: | 454.4 |
| Molecular Formula: | C24 H14 N4 O6 |
| Smiles: | c1ccc2c(cccc2c1)c1nc2cc(ccc2o1)NC(c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.214 |
| logD: | 4.8776 |
| logSw: | -6.2848 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.33 |
| InChI Key: | FTNKRSLMMICOKS-UHFFFAOYSA-N |