1-(3,4-dihydroisoquinolin-2(1H)-yl)-2,2-dimethylpropan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2,2-dimethylpropan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2,2-dimethylpropan-1-one
Compound characteristics
| Compound ID: | Y300-3147 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2,2-dimethylpropan-1-one |
| Molecular Weight: | 217.31 |
| Molecular Formula: | C14 H19 N O |
| Smiles: | CC(C)(C)C(N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0263 |
| logD: | 3.0263 |
| logSw: | -3.0486 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 16.8201 |
| InChI Key: | HWSYMHFJGZIIOP-UHFFFAOYSA-N |