N-[4-(4-methoxyphenyl)-6-phenylpyrimidin-2-yl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(4-methoxyphenyl)-6-phenylpyrimidin-2-yl]-3-nitrobenzamide
N-[4-(4-methoxyphenyl)-6-phenylpyrimidin-2-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | D419-2353 |
| Compound Name: | N-[4-(4-methoxyphenyl)-6-phenylpyrimidin-2-yl]-3-nitrobenzamide |
| Molecular Weight: | 426.43 |
| Molecular Formula: | C24 H18 N4 O4 |
| Smiles: | COc1ccc(cc1)c1cc(c2ccccc2)nc(NC(c2cccc(c2)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8747 |
| logD: | 5.8694 |
| logSw: | -5.6495 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.417 |
| InChI Key: | CUIBQHQDSVFRKB-UHFFFAOYSA-N |