N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamide
N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | G663-0171 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3(4H)-yl)acetamide |
| Molecular Weight: | 380.47 |
| Molecular Formula: | C20 H20 N4 O2 S |
| Smiles: | CSc1cccc(c1)NC(CN1C=Nc2c(cc3CCCCc3n2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3438 |
| logD: | 3.3426 |
| logSw: | -3.6224 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.101 |
| InChI Key: | ISQBYNRUQOHWBU-UHFFFAOYSA-N |