methyl 3-(2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl)benzoate
Chemical Structure Depiction of
methyl 3-(2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl)benzoate
methyl 3-(2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl)benzoate
Compound characteristics
| Compound ID: | 8009-0304 |
| Compound Name: | methyl 3-(2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl)benzoate |
| Molecular Weight: | 347.33 |
| Molecular Formula: | C19 H13 N3 O4 |
| Smiles: | COC(c1cccc(c1)N1C2C(=Cc3ccccc13)C(NC(N=2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.062 |
| logD: | 2.0615 |
| logSw: | -2.9449 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.936 |
| InChI Key: | PGKCZMJXRWRNFM-UHFFFAOYSA-N |