2-cyano-N-ethyl-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-N-ethyl-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
2-cyano-N-ethyl-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide
Compound characteristics
Compound ID: | 6392-0811 |
Compound Name: | 2-cyano-N-ethyl-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide |
Molecular Weight: | 402.45 |
Molecular Formula: | C23 H22 N4 O3 |
Smiles: | CCc1ccc(cc1)OC1=C(\C=C(/C#N)C(NCC)=O)C(N2C=CC=C(C)C2=N1)=O |
Stereo: | ACHIRAL |
logP: | 3.002 |
logD: | 3.0017 |
logSw: | -3.3065 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.13 |
InChI Key: | JONWVLFSZVOBKW-UHFFFAOYSA-N |