1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | D306-0109 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-[(6-methylpyrimidin-4-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 299.39 |
| Molecular Formula: | C16 H17 N3 O S |
| Smiles: | Cc1cc(ncn1)SCC(N1CCCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7481 |
| logD: | 2.748 |
| logSw: | -3.0479 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.001 |
| InChI Key: | MRHXWUJWZDTLOB-UHFFFAOYSA-N |