N-benzyl-2-cyano-3-{2-[5-methyl-2-(propan-2-yl)phenoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enamide
Chemical Structure Depiction of
N-benzyl-2-cyano-3-{2-[5-methyl-2-(propan-2-yl)phenoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enamide
N-benzyl-2-cyano-3-{2-[5-methyl-2-(propan-2-yl)phenoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enamide
Compound characteristics
| Compound ID: | 6392-0385 |
| Compound Name: | N-benzyl-2-cyano-3-{2-[5-methyl-2-(propan-2-yl)phenoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enamide |
| Molecular Weight: | 478.55 |
| Molecular Formula: | C29 H26 N4 O3 |
| Smiles: | CC(C)c1ccc(C)cc1OC1=C(\C=C(/C#N)C(NCc2ccccc2)=O)C(N2C=CC=CC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7964 |
| logD: | 4.7519 |
| logSw: | -4.6033 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.298 |
| InChI Key: | YHISLHPHQMFWIM-UHFFFAOYSA-N |