2-cyano-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methoxyphenyl)prop-2-enamide
2-cyano-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 6392-0836 |
| Compound Name: | 2-cyano-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(4-methoxyphenyl)prop-2-enamide |
| Molecular Weight: | 480.52 |
| Molecular Formula: | C28 H24 N4 O4 |
| Smiles: | CCc1ccc(cc1)OC1=C(\C=C(/C#N)C(Nc2ccc(cc2)OC)=O)C(N2C=CC=C(C)C2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.776 |
| logD: | 4.5455 |
| logSw: | -4.5136 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.454 |
| InChI Key: | MCEHLIBRTSLLFG-UHFFFAOYSA-N |