methyl 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate
Chemical Structure Depiction of
methyl 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate
methyl 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate
Compound characteristics
| Compound ID: | 6392-0684 |
| Compound Name: | methyl 2-cyano-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate |
| Molecular Weight: | 375.38 |
| Molecular Formula: | C21 H17 N3 O4 |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)C(=O)OC)C2=O)Oc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1098 |
| logD: | 3.1098 |
| logSw: | -3.3179 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.993 |
| InChI Key: | SIABSMSZURQRTG-UHFFFAOYSA-N |