1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | D475-0083 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-hydroxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1H-pyrazol-4-yl]ethan-1-one |
| Molecular Weight: | 430.53 |
| Molecular Formula: | C24 H22 N4 O2 S |
| Smiles: | Cc1c(CC(N2CCc3ccccc3C2)=O)c(n(c2nc(cs2)c2ccccc2)n1)O |
| Stereo: | ACHIRAL |
| logP: | 4.4253 |
| logD: | 1.9348 |
| logSw: | -4.2171 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.42 |
| InChI Key: | YPMDLUPYESAQRE-UHFFFAOYSA-N |