1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Compound characteristics
| Compound ID: | 6264-0071 |
| Compound Name: | 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one |
| Molecular Weight: | 359.85 |
| Molecular Formula: | C20 H21 N O3 |
| Salt: | HCl |
| Smiles: | C(CN1CCc2ccccc2C1)C(c1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8502 |
| logD: | 2.7751 |
| logSw: | -3.4358 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.681 |
| InChI Key: | JBKHBQLYWOUEDY-UHFFFAOYSA-N |