1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]propan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]propan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]propan-1-one
Compound characteristics
| Compound ID: | D475-2432 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]propan-1-one |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C25 H24 N4 O2 S |
| Smiles: | Cc1c(CCC(N2CCc3ccccc3C2)=O)c(n(c2nc(cs2)c2ccccc2)n1)O |
| Stereo: | ACHIRAL |
| logP: | 4.5336 |
| logD: | 2.5473 |
| logSw: | -4.1698 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.42 |
| InChI Key: | NJCQDEGMWGZMQN-UHFFFAOYSA-N |