methyl 3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate
Chemical Structure Depiction of
methyl 3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate
methyl 3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate
Compound characteristics
Compound ID: | 6392-0653 |
Compound Name: | methyl 3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate |
Molecular Weight: | 440.25 |
Molecular Formula: | C20 H14 Br N3 O4 |
Smiles: | CC1=CC=CN2C1=NC(=C(\C=C(/C#N)C(=O)OC)C2=O)Oc1ccc(cc1)[Br] |
Stereo: | ACHIRAL |
logP: | 3.5203 |
logD: | 3.5203 |
logSw: | -3.6379 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 69.993 |
InChI Key: | CWUFKEJODXYWCO-UHFFFAOYSA-N |