methyl 2-[2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamido]benzoate
methyl 2-[2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | G663-0045 |
| Compound Name: | methyl 2-[2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamido]benzoate |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C21 H20 N4 O4 |
| Smiles: | COC(c1ccccc1NC(CN1C=Nc2c(cc3CCCCc3n2)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6075 |
| logD: | 2.5962 |
| logSw: | -3.1754 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.577 |
| InChI Key: | WXLPKGYAZNOOAV-UHFFFAOYSA-N |