6,7-diethoxy-1-(4-ethylphenyl)-2-[4-(propan-2-yl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
6,7-diethoxy-1-(4-ethylphenyl)-2-[4-(propan-2-yl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one
6,7-diethoxy-1-(4-ethylphenyl)-2-[4-(propan-2-yl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D145-2385 |
| Compound Name: | 6,7-diethoxy-1-(4-ethylphenyl)-2-[4-(propan-2-yl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 457.61 |
| Molecular Formula: | C30 H35 N O3 |
| Smiles: | CCc1ccc(cc1)C1c2cc(c(cc2CC(N1c1ccc(cc1)C(C)C)=O)OCC)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5416 |
| logD: | 6.5416 |
| logSw: | -5.5767 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.7379 |
| InChI Key: | ZLEUZTHNGOBRDX-PMERELPUSA-N |