2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzenesulfonate
Chemical Structure Depiction of
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzenesulfonate
2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzenesulfonate
Compound characteristics
| Compound ID: | 3456-3858 |
| Compound Name: | 2,2,4-trimethyl-1,2-dihydroquinolin-6-yl benzenesulfonate |
| Molecular Weight: | 329.42 |
| Molecular Formula: | C18 H19 N O3 S |
| Smiles: | CC1=CC(C)(C)Nc2ccc(cc12)OS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2588 |
| logD: | 4.2586 |
| logSw: | -4.3349 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.199 |
| InChI Key: | PNHHYPFHWMUSNC-UHFFFAOYSA-N |