1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-1H-pyrazol-1-yl)ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8017-5774 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-iodo-1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 367.19 |
| Molecular Formula: | C14 H14 I N3 O |
| Smiles: | C1CN(Cc2ccccc12)C(Cn1cc(cn1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3451 |
| logD: | 2.3451 |
| logSw: | -2.3986 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.7984 |
| InChI Key: | DMIUIXMHIWLSAN-UHFFFAOYSA-N |