1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]propan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]propan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]propan-1-one
Compound characteristics
| Compound ID: | G402-1272 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]propan-1-one |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C23 H32 N4 O3 S |
| Smiles: | CC1CCN(CC1)S(c1c(C)nn(CCC(N2CCc3ccccc3C2)=O)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2605 |
| logD: | 2.2605 |
| logSw: | -2.4988 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.264 |
| InChI Key: | ZYZFYGHZRGVFBO-UHFFFAOYSA-N |