1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[(5-methylthiophen-3-yl)methyl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[(5-methylthiophen-3-yl)methyl]sulfanyl}ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[(5-methylthiophen-3-yl)methyl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | E728-0032 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[(5-methylthiophen-3-yl)methyl]sulfanyl}ethan-1-one |
| Molecular Weight: | 317.47 |
| Molecular Formula: | C17 H19 N O S2 |
| Smiles: | Cc1cc(CSCC(N2CCCc3ccccc23)=O)cs1 |
| Stereo: | ACHIRAL |
| logP: | 4.3948 |
| logD: | 4.3948 |
| logSw: | -4.269 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 16.0422 |
| InChI Key: | HRXIMPXLUPULLU-UHFFFAOYSA-N |