N-[4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-2-yl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-2-yl]-3-nitrobenzamide
N-[4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-2-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | D419-2487 |
| Compound Name: | N-[4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-2-yl]-3-nitrobenzamide |
| Molecular Weight: | 440.46 |
| Molecular Formula: | C25 H20 N4 O4 |
| Smiles: | Cc1ccc(cc1)c1cc(c2ccc(cc2)OC)nc(NC(c2cccc(c2)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.4032 |
| logD: | 6.3979 |
| logSw: | -5.7221 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.417 |
| InChI Key: | GNRKVCLDNCPUFH-UHFFFAOYSA-N |