5-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Chemical Structure Depiction of
5-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
5-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione
Compound characteristics
| Compound ID: | 8017-5388 |
| Compound Name: | 5-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-2,4,6(1H,3H,7H)-trione |
| Molecular Weight: | 443.38 |
| Molecular Formula: | C22 H16 F3 N3 O4 |
| Smiles: | C1CC2=C(C(C3=C(N2)NC(NC3=O)=O)c2ccc(c3cccc(c3)C(F)(F)F)o2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1736 |
| logD: | 1.3914 |
| logSw: | -3.4666 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.37 |
| InChI Key: | ALTHFZGWMKPLDM-KRWDZBQOSA-N |