2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-[(oxolan-2-yl)methyl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-[(oxolan-2-yl)methyl]prop-2-enamide
2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-[(oxolan-2-yl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | 6392-0692 |
| Compound Name: | 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-[(oxolan-2-yl)methyl]prop-2-enamide |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C25 H24 N4 O4 |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)C(NCC1CCCO1)=O)C2=O)Oc1ccc(C)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4061 |
| logD: | 2.4031 |
| logSw: | -2.7751 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.887 |
| InChI Key: | KZIWQJRSHHPKQO-HXUWFJFHSA-N |