3-[2-(2-chlorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-[(oxolan-2-yl)methyl]prop-2-enamide
Chemical Structure Depiction of
3-[2-(2-chlorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-[(oxolan-2-yl)methyl]prop-2-enamide
3-[2-(2-chlorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-[(oxolan-2-yl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | 6392-0847 |
| Compound Name: | 3-[2-(2-chlorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-[(oxolan-2-yl)methyl]prop-2-enamide |
| Molecular Weight: | 464.91 |
| Molecular Formula: | C24 H21 Cl N4 O4 |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)C(NCC1CCCO1)=O)C2=O)Oc1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3639 |
| logD: | 2.3609 |
| logSw: | -3.1736 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.974 |
| InChI Key: | BCNSRFGRHCGSGT-QGZVFWFLSA-N |