1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methylpyrimidin-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methylpyrimidin-5-yl]ethan-1-one
1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methylpyrimidin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8019-0278 |
| Compound Name: | 1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-4-methylpyrimidin-5-yl]ethan-1-one |
| Molecular Weight: | 267.33 |
| Molecular Formula: | C16 H17 N3 O |
| Smiles: | CC(c1cnc(nc1C)N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4649 |
| logD: | 2.4649 |
| logSw: | -2.581 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.776 |
| InChI Key: | MTIWFZHRCVKVIL-UHFFFAOYSA-N |