2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methylphenyl)prop-2-enamide
2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 6392-1006 |
| Compound Name: | 2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methylphenyl)prop-2-enamide |
| Molecular Weight: | 464.52 |
| Molecular Formula: | C28 H24 N4 O3 |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)C(Nc1ccc(C)cc1)=O)C2=O)Oc1cccc(C)c1C |
| Stereo: | ACHIRAL |
| logP: | 5.0772 |
| logD: | 4.9192 |
| logSw: | -4.8393 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.997 |
| InChI Key: | LBYIFURSARXLHO-UHFFFAOYSA-N |