N-[4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-2-nitrobenzamide
N-[4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | F306-0012 |
| Compound Name: | N-[4-(2-methyl-4-oxopyrido[2,3-d]pyrimidin-3(4H)-yl)phenyl]-2-nitrobenzamide |
| Molecular Weight: | 401.38 |
| Molecular Formula: | C21 H15 N5 O4 |
| Smiles: | CC1=Nc2c(cccn2)C(N1c1ccc(cc1)NC(c1ccccc1[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3001 |
| logD: | 2.1746 |
| logSw: | -3.0773 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.57 |
| InChI Key: | GTYKFNZSZCNLSM-UHFFFAOYSA-N |