6,7-diethoxy-2-(4-ethylphenyl)-1-(3-methylphenyl)-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
6,7-diethoxy-2-(4-ethylphenyl)-1-(3-methylphenyl)-1,4-dihydroisoquinolin-3(2H)-one
6,7-diethoxy-2-(4-ethylphenyl)-1-(3-methylphenyl)-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D145-2166 |
| Compound Name: | 6,7-diethoxy-2-(4-ethylphenyl)-1-(3-methylphenyl)-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C28 H31 N O3 |
| Smiles: | CCc1ccc(cc1)N1C(c2cccc(C)c2)c2cc(c(cc2CC1=O)OCC)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7415 |
| logD: | 5.7415 |
| logSw: | -5.3798 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.7379 |
| InChI Key: | IMPTVPXMNXJPDT-NDEPHWFRSA-N |