N-(2,8-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-(2,8-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-3-methyl-4-nitrobenzamide
N-(2,8-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-3-methyl-4-nitrobenzamide
Compound characteristics
Compound ID: | G746-0200 |
Compound Name: | N-(2,8-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-3-methyl-4-nitrobenzamide |
Molecular Weight: | 352.35 |
Molecular Formula: | C18 H16 N4 O4 |
Smiles: | CC1C=CN2C(C=1)=NC(C)=C(C2=O)NC(c1ccc(c(C)c1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0579 |
logD: | 0.2323 |
logSw: | -2.729 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.507 |
InChI Key: | ATBBYRVHUBOOEC-UHFFFAOYSA-N |