3-[2-(4-tert-butylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile
Chemical Structure Depiction of
3-[2-(4-tert-butylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile
3-[2-(4-tert-butylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 6392-0638 |
| Compound Name: | 3-[2-(4-tert-butylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C27 H28 N4 O4 |
| Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)C(N1CCOCC1)=O)C2=O)Oc1ccc(cc1)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.6912 |
| logD: | 3.6912 |
| logSw: | -3.9302 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.376 |
| InChI Key: | HYEBHMJODXBRDI-UHFFFAOYSA-N |