3-ethyl-2-sulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Chemical Structure Depiction of
3-ethyl-2-sulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
3-ethyl-2-sulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Compound characteristics
| Compound ID: | 8016-5412 |
| Compound Name: | 3-ethyl-2-sulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one |
| Molecular Weight: | 261.34 |
| Molecular Formula: | C13 H15 N3 O S |
| Smiles: | CCN1C(=Nc2c(cc3CCCCc3n2)C1=O)S |
| Stereo: | ACHIRAL |
| logP: | 2.6967 |
| logD: | -0.8198 |
| logSw: | -2.7828 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.158 |
| InChI Key: | RYMPDWNZCQXSCM-UHFFFAOYSA-N |