3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Chemical Structure Depiction of
3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Compound characteristics
| Compound ID: | 5218-2292 |
| Compound Name: | 3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C26 H23 N3 O2 S |
| Smiles: | Cc1ccccc1N1C(=Nc2c(cc3CCCCc3n2)C1=O)SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2028 |
| logD: | 5.1842 |
| logSw: | -5.0488 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.718 |
| InChI Key: | LRTQYMGFCWJLMI-UHFFFAOYSA-N |