N-[2-methyl-4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[2-methyl-4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-4-nitrobenzamide
N-[2-methyl-4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | F306-0099 |
| Compound Name: | N-[2-methyl-4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-4-nitrobenzamide |
| Molecular Weight: | 415.41 |
| Molecular Formula: | C22 H17 N5 O4 |
| Smiles: | CC1=Nc2c(cccn2)C(N1c1ccc(c(C)c1)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8793 |
| logD: | 2.5549 |
| logSw: | -3.5469 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.173 |
| InChI Key: | HJFBSHMXRRFYGA-UHFFFAOYSA-N |