1-(3,4-dihydroisoquinolin-2(1H)-yl)-6-[(pyrimidin-2-yl)amino]hexan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-6-[(pyrimidin-2-yl)amino]hexan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-6-[(pyrimidin-2-yl)amino]hexan-1-one
Compound characteristics
| Compound ID: | Y041-7225 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-6-[(pyrimidin-2-yl)amino]hexan-1-one |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C19 H24 N4 O |
| Smiles: | C(CCC(N1CCc2ccccc2C1)=O)CCNc1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 2.0864 |
| logD: | 2.0864 |
| logSw: | -2.5792 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.938 |
| InChI Key: | CTMWQKDIRSBRMI-UHFFFAOYSA-N |