1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8016-8481 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 395.24 |
| Molecular Formula: | C16 H18 I N3 O |
| Smiles: | Cc1c(c(C)n(CC(N2CCc3ccccc3C2)=O)n1)I |
| Stereo: | ACHIRAL |
| logP: | 2.1373 |
| logD: | 2.1373 |
| logSw: | -2.3442 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.5745 |
| InChI Key: | UZYWITKBIKTAEY-UHFFFAOYSA-N |