(3,4-dihydroisoquinolin-2(1H)-yl)(4,5-dimethoxy-2-nitrophenyl)methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)(4,5-dimethoxy-2-nitrophenyl)methanone
(3,4-dihydroisoquinolin-2(1H)-yl)(4,5-dimethoxy-2-nitrophenyl)methanone
Compound characteristics
| Compound ID: | Y032-0209 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)(4,5-dimethoxy-2-nitrophenyl)methanone |
| Molecular Weight: | 342.35 |
| Molecular Formula: | C18 H18 N2 O5 |
| Smiles: | COc1cc(C(N2CCc3ccccc3C2)=O)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.695 |
| logD: | 2.695 |
| logSw: | -3.1513 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.89 |
| InChI Key: | IVXOTFOUZXTEPL-UHFFFAOYSA-N |