1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | D351-0513 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one |
| Molecular Weight: | 352.46 |
| Molecular Formula: | C19 H20 N4 O S |
| Smiles: | Cc1cc(C)n(c2nc(CC(N3CCc4ccccc4C3)=O)cs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2359 |
| logD: | 3.2359 |
| logSw: | -3.2401 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.208 |
| InChI Key: | CINALJHOQDUOMU-UHFFFAOYSA-N |