2,2,4-trimethyl-1,2-dihydroquinolin-6-yl phenyl(phenylsulfanyl)acetate
Chemical Structure Depiction of
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl phenyl(phenylsulfanyl)acetate
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl phenyl(phenylsulfanyl)acetate
Compound characteristics
| Compound ID: | 5594-2022 |
| Compound Name: | 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl phenyl(phenylsulfanyl)acetate |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C26 H25 N O2 S |
| Smiles: | CC1=CC(C)(C)Nc2ccc(cc12)OC(C(c1ccccc1)Sc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8658 |
| logD: | 6.8658 |
| logSw: | -5.7531 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.5434 |
| InChI Key: | ONMUAPRDROTRGJ-XMMPIXPASA-N |