N-(2H-1,3-benzodioxol-5-yl)-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)butanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)butanamide
N-(2H-1,3-benzodioxol-5-yl)-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)butanamide
Compound characteristics
| Compound ID: | G663-0973 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)butanamide |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Smiles: | CCC(C(Nc1ccc2c(c1)OCO2)=O)N1C=Nc2c(cc3CCCCc3n2)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2871 |
| logD: | 3.2869 |
| logSw: | -3.474 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.521 |
| InChI Key: | DWTIVOBYVPTDKF-KRWDZBQOSA-N |