2-(ethylsulfanyl)ethyl 2-methyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 2-methyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-(ethylsulfanyl)ethyl 2-methyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 3607-5733 |
| Compound Name: | 2-(ethylsulfanyl)ethyl 2-methyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C24 H31 N O4 S |
| Smiles: | CCSCCOC(C1C(C2=C(CCCC2=O)NC=1C)c1ccccc1OC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5144 |
| logD: | 0.6186 |
| logSw: | -4.3657 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.858 |
| InChI Key: | NJZDZCSEIGJSNX-QFIPXVFZSA-N |