1-(4-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}phenyl)ethan-1-one
1-(4-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F080-1085 |
| Compound Name: | 1-(4-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}phenyl)ethan-1-one |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C22 H21 N3 O2 S |
| Smiles: | CC(c1ccc(cc1)Nc1c(cnc2ccccc12)C(N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8008 |
| logD: | 2.796 |
| logSw: | -3.198 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.083 |
| InChI Key: | DYYPIXYIVJGPIH-UHFFFAOYSA-N |