1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-(4-methoxyphenyl)-3-methyl-1H-pyrazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-(4-methoxyphenyl)-3-methyl-1H-pyrazol-4-yl]ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-(4-methoxyphenyl)-3-methyl-1H-pyrazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | Y041-7675 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[5-(4-methoxyphenyl)-3-methyl-1H-pyrazol-4-yl]ethan-1-one |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C22 H23 N3 O2 |
| Smiles: | Cc1c(CC(N2CCc3ccccc3C2)=O)c(c2ccc(cc2)OC)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7632 |
| logD: | 3.763 |
| logSw: | -4.1411 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.402 |
| InChI Key: | VHHMVSDFMUREGB-UHFFFAOYSA-N |